Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 3/20 | 0.53 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.49 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.49 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.49 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | GLS | O94925 | 2/20 | 0.45 |
| ▸ | FAAH | O00519 | 1/20 | 0.45 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.45 |
| ▸ | AGXT | P21549 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1444688 | 0.86 | CYP2A6 (0.51) | CYP2A6ADRB2ASIC3LOXL2BCL2L1 | |
| SCHEMBL1806012 | 0.85 | CYP2A6 (0.50) | CYP2A6ADRB2ASIC3LOXL2BCL2L1 | |
| SCHEMBL793123 | 0.83 | HDAC3 (0.47) | CYP2A6ADRB2ASIC3LOXL2RAB9A | |
| SCHEMBL1444757 | 0.80 | CYP2A6 (0.59) | CYP2A6ADRB2ASIC3LOXL2BCL2L1 | |
| Hydrochloric Acid SCHEMBL4499713 | 0.79 | CYP2A6 (0.50) | CYP2A6ADRB2ASIC3LOXL2RAB9A | |
| SCHEMBL4510014 | 0.79 | CYP2A6 (0.58) | CYP2A6ADRB2ASIC3LOXL2BCL2L1 | |
| SCHEMBL17209265 | 0.77 | EPHX1 (0.49) | CYP2A6ADRB2HDAC3HDAC1HDAC2 | |
| SCHEMBL17209264 | 0.77 | MAPT (0.50) | MEN1USP2POLBBLMKMT2A | |
| SCHEMBL14756368 | 0.77 | CYP2A6 (0.69) | CYP2A6ADRB2ASIC3LOXL2RAB9A | |
| SCHEMBL20509374 | 0.76 | MME (0.43) | CYP2A6ADRB2ASIC3LOXL2RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4985422-A | TRICYCLIC, IMIDAZOLE SUBSTITUTED, ANTAGONIST OF HYDROXYTRYPTAMINE RECEPTORS, PSYCHOTIC DISORDERS, SCHIZOPHRENIA | GLAXO GROUP LIMITED (GB) | 1991-01-15 | — | — | US | disclosed |
| EP-0339959-A2 | Lactam derivatives | GLAXO GROUP LIMITED (GB) | 1989-11-02 | — | — | EP | disclosed |