Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 1/20 | 0.42 |
| ▸ | KIF11 | P52732 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 5/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.35 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.35 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11173175 | 0.82 | KIF11 (0.41) | ADORA2BKIF11MAPTNPC1RAB9A | |
| SCHEMBL11069575 | 0.79 | NOS3 (0.48) | ADORA2BMAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL21223615 | 0.75 | ADORA2B (0.47) | ADORA2BCYP2D6CYP1A2CYP2E1CYP2A6 | |
| SCHEMBL18039107 | 0.73 | ADORA2B (0.68) | ADORA2BCYP2D6MAPTNPC1RAB9A | |
| SCHEMBL4619304 | 0.73 | GABRP (0.46) | ADORA2BCYP2D6CYP1A2CYP2E1CYP2A6 | |
| SCHEMBL11065116 | 0.72 | GABRP (0.42) | ADORA2BCYP2D6CYP1A2CYP2E1CYP2A6 | |
| SCHEMBL11236617 | 0.71 | RAB9A (0.38) | MAPTNPC1RAB9AMEN1KMT2A | |
| SCHEMBL11069039 | 0.71 | ADORA2B (0.42) | ADORA2BCYP2D6CYP1A2CYP2E1CYP2A6 | |
| SCHEMBL31193319 | 0.71 | ADORA2B (0.42) | ADORA2BMAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL11164012 | 0.71 | GABRP (0.51) | ADORA2BCYP2D6CYP1A2CYP2E1CYP2A6 |
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-4448780-A | N-(Lower-alkyl)-N'-[5-(pyridinyl)-2-pyridinyl]ureas and cardiotonic use thereof | STERLING DRUG INC. (US) | 1984-05-15 | — | — | US | disclosed |
| US-4420617-A | 5(Pyridinyl)pyridin-2-amines | STERLING DRUG INC. (US) | 1983-12-13 | — | — | US | disclosed |