Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.37 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | MIF | P14174 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.33 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29648452 | 1.00 | CES1 (0.43) | CES1MAOBMAOACYP2A6PDPK1 | |
| SCHEMBL2675857 | 0.82 | ALOX5 (0.38) | CES1MAOBMAOACYP2A6PDPK1 | |
| SCHEMBL2863342 | 0.81 | HTR6 (0.42) | CES1MAOBMAOACYP2A6PDPK1 | |
| SCHEMBL15780617 | 0.80 | CES1 (0.39) | CES1MAOBMAOACYP2A6PDPK1 | |
| SCHEMBL5327197 | 0.78 | MEN1 (0.36) | MAOBMAOACYP2A6L3MBTL1 | |
| SCHEMBL2526007 | 0.77 | CES1 (0.48) | CES1MAOBMAOACYP2A6PDPK1 | |
| SCHEMBL19775784 | 0.72 | CES1 (0.39) | CES1MAOBMAOACYP2A6PDPK1 | |
| SCHEMBL2674629 | 0.72 | SIGMAR1 (0.43) | CES1MAOBMAOACYP2A6PDPK1 | |
| SCHEMBL28780467 | 0.71 | PARP10 (0.44) | CYP2A6PARP10PARP11 | |
| SCHEMBL22682127 | 0.70 | AR (0.36) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114605314-B | Indene derivative and application thereof | 上海八亿时空先进材料有限公司 | 2024-04-02 | — | — | CN | disclosed |
| WO-2023161857-A1 | BIFUNCTIONAL CYTOKINE COMPOSITIONS | BRIGHT PEAK THERAPEUTICS AG (CH) | 2023-08-31 | — | — | WO | disclosed |
| CN-114605314-A | Indene derivative and application thereof | 上海八亿时空先进材料有限公司 | 2022-06-10 | — | — | CN | disclosed |
| WO-2001042181-A1 | BENZYL TETRALINS, FORMULATIONS AND USES THEREOF | UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) | 2001-06-14 | — | — | WO | disclosed |
| EP-0540697-A1 | NOVEL SULFONYLUREAS | Novartis AG (CH) | 1993-05-12 | — | — | EP | disclosed |
| EP-0281283-B1 | HETEROCYCLIC COMPOUNDS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-02-10 | — | — | EP | disclosed |
| US-4910212-A | Containing 1,2,4-triazole or imidazole ring | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1990-03-20 | — | — | US | disclosed |
| EP-0281283-A1 | Heterocyclic compounds | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1988-09-07 | — | — | EP | disclosed |