Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 5/20 | 0.58 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.50 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.50 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.50 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | CDK8 | P49336 | 1/20 | 0.49 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.49 |
| ▸ | NEK1 | Q96PY6 | 4/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.47 |
| ▸ | AXL | P30530 | 1/20 | 0.47 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.47 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6434460 | 0.85 | SMN1; SMN2 (0.56) | NPC1MAPTRAB9AMEN1PSIP1 | |
| SCHEMBL2875365 | 0.85 | CA12 (0.61) | NPC1MAPTRAB9AGABRG2GABRB3 | |
| SCHEMBL29441704 | 0.85 | CA12 (0.61) | NPC1MAPTRAB9AGABRG2GABRB3 | |
| SCHEMBL31418026 | 0.84 | CYP11B1 (0.59) | CYP11B2CYP11B1GABRG2GABRB3GABRA5 | |
| SCHEMBL10093458 | 0.84 | ATM (0.59) | CYP11B2CYP11B1GABRG2GABRB3GABRA5 | |
| Hydrochloric Acid SCHEMBL6233341 | 0.83 | CA12 (0.60) | NPC1MAPTRAB9AGABRG2GABRB3 | |
| SCHEMBL9008962 | 0.83 | CYP11B1 (0.61) | CYP11B2CYP11B1GABRG2GABRB3GABRA5 | |
| SCHEMBL4592371 | 0.83 | CYP11B1 (0.58) | CYP11B2CYP11B1GABRG2GABRB3GABRA5 | |
| SCHEMBL3715051 | 0.83 | ATM (0.69) | CYP11B2CYP11B1GABRG2GABRB3GABRA5 | |
| SCHEMBL3714867 | 0.81 | ALDH1A1 (0.68) | CYP11B2CYP11B1ATMCYP2A6NEK1 |
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-1850081-A | Use of 5-(3-aminobenzene)methyl nicotinate and its ahalogue as PI3K enzyme inhibitor | UNIV HUADONG TECHNOLOGY (CN) | 2006-10-25 | — | — | CN | claimed |
| CN-1850081-A | Use of 5-(3-aminobenzene)methyl nicotinate and its ahalogue as PI3K enzyme inhibitor | UNIV HUADONG TECHNOLOGY (CN) | 2006-10-25 | — | — | CN | disclosed |
| EP-1087943-B1 | THERAPEUTIC BIARYL DERIVATIVES | GLAXO GROUP LTD (GB) | 2005-08-17 | — | — | EP | disclosed |
| CN-1214008-C | Therapeutic biaryl derivatives | GLAXO GROUP LTD (GB) | 2005-08-10 | — | — | CN | disclosed |
| CN-1312800-A | Therapeutic biaryl derivatives | GLAXO GROUP LTD (GB) | 2001-09-12 | — | — | CN | disclosed |
| US-6251925-B1 | AN AGONISTS FOR HUMAN BETA-3 ADRENOCEPTOR | GLAXO WELLCOME INC. | 2001-06-26 | — | — | US | disclosed |
| EP-1087943-A1 | THERAPEUTIC BIARYL DERIVATIVES | GLAXO GROUP LIMITED (GB) | 2001-04-04 | — | — | EP | disclosed |
| WO-1999065877-A1 | THERAPEUTIC BIARYL DERIVATIVES | GLAXO GROUP LIMITED (GB) | 1999-12-23 | — | — | WO | disclosed |