Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAPRT | Q6XQN6 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MPO | P05164 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | P2RX7 | Q99572 | 5/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | PLOD2 | O00469 | 2/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | PLOD3 | O60568 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | PLOD1 | Q02809 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Pyridine SCHEMBL4655282 | 0.86 | TDP1 (0.47) | NAPRTTSHRTDP1CYP1A2CYP3A4 | |
| Pyridine SCHEMBL27474885 | 0.86 | CYP1A2 (0.53) | NAPRTTSHRTDP1CYP1A2CYP3A4 | |
| Pyridine SCHEMBL10974779 | 0.84 | NAPRT (0.45) | NAPRTTSHRTDP1CYP1A2CYP3A4 | |
| Pyridazine SCHEMBL27711578 | 0.83 | P2RX7 (0.43) | NAPRTTSHRCYP1A2CYP3A4CYP2D6 | |
| Pyridine SCHEMBL10980010 | 0.82 | NAPRT (0.43) | NAPRTTSHRTDP1CYP1A2CYP3A4 | |
| Benzene SCHEMBL28076350 | 0.82 | CYP1A2 (0.47) | TSHRTDP1CYP1A2CYP3A4CYP2D6 | |
| Pyridine SCHEMBL7904912 | 0.80 | NAPRT (0.53) | NAPRTTSHRTDP1CYP1A2CYP3A4 | |
| Pyridine SCHEMBL9065525 | 0.79 | NAPRT (0.60) | NAPRTTSHRTDP1CYP1A2CYP3A4 | |
| Pyridine SCHEMBL1164077 | 0.79 | NAPRT (0.60) | NAPRTTSHRTDP1CYP1A2CYP3A4 | |
| Pyridine SCHEMBL1070164 | 0.79 | NAPRT (0.60) | NAPRTTSHRTDP1CYP1A2CYP3A4 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110483423-A | P2X4 receptor antagonist | NIPPON CHEMIPHAR CO | 2019-11-22 | — | — | CN | disclosed |
| CN-104350055-B | Bicyclic heteroaryl derivatives and application thereof as MNK1 and MNK2 regulator | 新加坡科技研究局 | 2019-05-31 | — | — | CN | disclosed |
| CN-109689649-A | BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS | 百时美施贵宝公司 | 2019-04-26 | — | — | CN | disclosed |
| CN-108863959-A | P2X4 RECEPTOR ANTAGONIST | 日本化学药品株式会社 | 2018-11-23 | — | — | CN | disclosed |
| CN-103635467-B | Oxaziza compounds as ion channel modulators | 吉利德科学公司 | 2017-08-04 | — | — | CN | disclosed |
| CN-101454320-B | Pyridine[3,4-b]pyrazinones | PFIZER PROD INC | 2012-12-19 | — | — | CN | disclosed |
| EP-2235092-B1 | COATED POLYOXYMETHYLENES | BASF SE (DE) | 2012-03-14 | — | — | EP | disclosed |
| CN-102256964-A | Compuestos inhibidores de quinasa map p38 | RESPIVERT LTD | 2011-11-23 | — | — | CN | disclosed |
| EP-2235092-A1 | COATED POLYOXYMETHYLENES | BASF SE (DE) | 2010-10-06 | — | — | EP | disclosed |
| WO-2009092698-A1 | COATED POLYOXYMETHYLENES | BASF SE (DE) | 2009-07-30 | — | — | WO | disclosed |
| CN-101400678-A | Thiophene amides useful as protein kinase inhibitors | VERTEX PHARMA (US) | 2009-04-01 | — | — | CN | disclosed |
| CN-101384586-A | PI-3 kinase inhibitors and methods of use thereof | NOVARTIS AG (CH) | 2009-03-11 | — | — | CN | disclosed |
| CN-101137376-A | Diphenyl substituted cycloalkanes, compositions containing such compounds and methods of use | MERCK & CO INC (US) | 2008-03-05 | — | — | CN | disclosed |
| CN-1130365-C | Alpha-1 adrenergic compounds, pharmaceutical compositions containing the same and uses thereof | ABBOTT CO (US) | 2003-12-10 | — | — | CN | disclosed |
| CN-1246861-A | Benzopyranopyrrole and benzopyranopyridine alpha-1 adrenergic compounds | ABBOTT LAB (US) | 2000-03-08 | — | — | CN | disclosed |
| EP-0159962-B1 | FIBRE-REACTIVE CHROMIUM OR COBALT COMPLEXES, THEIR PREPARATION AND THEIR USE | CIBA-GEIGY AG (CH) | 1989-02-08 | — | — | EP | disclosed |
| EP-0159962-A2 | Fibre-reactive chromium or cobalt complexes, their preparation and their use | CIBA-GEIGY AG (CH) | 1985-10-30 | — | — | EP | disclosed |