Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.82 |
| ▸ | NPC1 | O15118 | 2/20 | 0.82 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.55 |
| ▸ | KMO | O15229 | 3/20 | 0.49 |
| ▸ | DHFR | P00374 | 1/20 | 0.47 |
| ▸ | AHR | P35869 | 2/20 | 0.46 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.44 |
| ▸ | IKBKB | O14920 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9566581 | 0.90 | RAB9A (1.00) | RAB9ANPC1HRH4KMODHFR | |
| SCHEMBL10925902 | 0.79 | NPC1 (0.80) | RAB9ANPC1HRH4DHFRHTR2B | |
| SCHEMBL9566548 | 0.77 | RAB9A (0.75) | RAB9ANPC1HRH4KMODHFR | |
| SCHEMBL9566620 | 0.77 | RAB9A (0.75) | RAB9ANPC1HRH4DHFRHTR2B | |
| SCHEMBL6584030 | 0.76 | HRH4 (0.56) | RAB9ANPC1HRH4DHFRADORA1 | |
| SCHEMBL6986219 | 0.76 | ADORA1 (0.67) | RAB9ANPC1HRH4IKBKBKDM4E | |
| SCHEMBL27774680 | 0.76 | NPC1 (0.57) | RAB9ANPC1HRH4DHFRIKBKB | |
| SCHEMBL10923642 | 0.75 | RAB9A (0.64) | RAB9ANPC1HRH4KMODHFR | |
| SCHEMBL2250601 | 0.75 | ADORA2A (0.72) | RAB9ANPC1HRH4KDM4EALDH1A1 | |
| SCHEMBL30205277 | 0.75 | ADORA2A (0.72) | RAB9ANPC1HRH4KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015155129-A1 | DIAMINOTRIAZINE COMPOUND | BASF SE (DE) | 2015-10-15 | — | — | WO | disclosed |
| EP-0066799-B1 | NICOTINIC ACID DERIVATIVES | NIPPON SHINYAKU COMPANY, LIMITED (JP) | 1986-01-02 | — | — | EP | disclosed |
| US-4415570-A | TREATMENT FOR RHEMATIC DISEASES AND ALLERGIC NEPHRYTIS; UROGENITAL DISORDERS | NIPPON SHINYAKU CO. LTD. (JP) | 1983-11-15 | — | — | US | disclosed |
| EP-0066799-A2 | Nicotinic acid derivatives | NIPPON SHINYAKU COMPANY, LIMITED (JP) | 1982-12-15 | — | — | EP | disclosed |
| US-4333933-A | ANTIINFLAMMATORY, REACTING HALO BENZOGUANAMINE WITH NICOTINE ACID DERIVAGIVE | NIPPON SHINYAKU CO., LTD. (JP) | 1982-06-08 | — | — | US | disclosed |