Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.66 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.59 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.57 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.57 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.54 |
| ▸ | SLC13A5 | Q86YT5 | 1/20 | 0.51 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.51 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | SOX18 | P35713 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9404005 | 0.92 | CYP1A2 (0.62) | CYP1A2PDPK1HDAC1HDAC8FFAR1 | |
| SCHEMBL23662913 | 0.89 | IAPP (0.60) | CYP1A2PDPK1HDAC1HDAC8FFAR1 | |
| SCHEMBL27891937 | 0.89 | CYP1A2 (0.58) | CYP1A2PDPK1HDAC1HDAC8FFAR1 | |
| SCHEMBL30403190 | 0.86 | CYP1A2 (0.80) | CYP1A2PDPK1HDAC1HDAC8FFAR1 | |
| SCHEMBL1217683 | 0.86 | CYP1A2 (0.80) | CYP1A2PDPK1HDAC1HDAC8FFAR1 | |
| SCHEMBL7191582 | 0.85 | CYP1A2 (0.62) | CYP1A2PDPK1HDAC1HDAC8FFAR1 | |
| Hydrochloric Acid SCHEMBL27401796 | 0.85 | CYP1A2 (0.77) | CYP1A2PDPK1HDAC1HDAC8FFAR1 | |
| SCHEMBL5236795 | 0.85 | CYP1A2 (0.68) | CYP1A2PDPK1HDAC1HDAC8FFAR1 | |
| SCHEMBL1137617 | 0.85 | CYP1A2 (0.62) | CYP1A2PDPK1HDAC1HDAC8FFAR1 | |
| SCHEMBL8476550 | 0.84 | TBXAS1 (0.50) | CYP1A2PDPK1HDAC1HDAC8CYP3A4 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102105452-A | Substituted carbinol compound having cyclic linker | KOWA CO | 2011-06-22 | — | — | CN | disclosed |
| EP-0771196-B1 | EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 1999-12-08 | — | — | EP | disclosed |
| US-5717109-A | CARBOXYCYCLOPROPYL GLYCINE DERIVATIVES; USEFUL FOR TREATMENT OF ACUTE OR CHRONIC NEURODEGENERATIVE CONDITIONS, AND AS ANTIPSYCHOTIC, ANTICONVULSANT, ANALGESIC, ANXIOLYTIC, ANTIDEPRESSANT AND ANTI-EMETIC AGENTS | ELI LILLY AND COMPANY (US) | 1998-02-10 | — | — | US | disclosed |
| EP-0771196-A4 | EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 1997-09-03 | — | — | EP | disclosed |
| EP-0771196-A1 | EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS | ELI LILLY AND COMPANY (US) | 1997-05-07 | — | — | EP | disclosed |
| WO-1996007405-A1 | EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS | ELI LILLY AND COMPANY (US) | 1996-03-14 | — | — | WO | disclosed |