Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | CYP2A13 | Q16696 | 5/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | DRD5 | P21918 | 1/20 | 0.40 |
| ▸ | NCF1 | P14598 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30115041 | 0.91 | SIGMAR1 (0.54) | SIGMAR1POLBCYP2A13L3MBTL1CNR1 | |
| SCHEMBL3718831 | 0.87 | SIGMAR1 (0.60) | SIGMAR1POLBCYP2A13L3MBTL1HRH3 | |
| SCHEMBL2327709 | 0.85 | HRH3 (0.59) | SIGMAR1L3MBTL1HRH3KCNH2 | |
| SCHEMBL6055273 | 0.83 | CYP2A13 (0.57) | CYP2A13HRH3CXCR4NCF1 | |
| SCHEMBL31172442 | 0.83 | CYP2A13 (0.57) | CYP2A13HRH3CXCR4NCF1 | |
| SCHEMBL28344098 | 0.81 | SIGMAR1 (0.49) | SIGMAR1POLBCYP2A13CNR1CNR2 | |
| SCHEMBL18108811 | 0.80 | PARP1 (0.53) | CNR1CNR2 | |
| SCHEMBL6526231 | 0.79 | POLB (0.47) | SIGMAR1POLB | |
| SCHEMBL22716816 | 0.78 | L3MBTL3 (0.39) | SIGMAR1L3MBTL1HRH3KCNH2 | |
| SCHEMBL5323909 | 0.77 | HRH3 (0.54) | SIGMAR1POLBCYP2A13L3MBTL1HRH3 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113924296-A | 1,3, 4-oxadiazole derivative compounds as histone deacetylase 6 inhibitors and pharmaceutical compositions comprising the same | 株式会社钟根堂 | 2022-01-11 | — | — | CN | disclosed |
| CN-105189481-A | Pyridine cdk9 kinase inhibitors | ABBVIE INC | 2015-12-23 | — | — | CN | disclosed |
| US-8138177-B2 | Benzimidazolone derivatives as CB2 receptor ligands | PFIZER INC. (US) | 2012-03-20 | — | — | US | disclosed |
| EP-1318978-B1 | N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS | ABBOTT LAB (US) | 2006-02-08 | — | — | EP | disclosed |
| US-5716953-A | MODIFIERS OF GASTRIN AND CHOLECYSTOKININS | GLAXO WELLCOME S.P.A. (IT) | 1998-02-10 | — | — | US | disclosed |