Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 2/20 | 0.47 |
| ▸ | PRKDC | P78527 | 4/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 4/20 | 0.46 |
| ▸ | PIK3CB | P42338 | 3/20 | 0.46 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.46 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.45 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.40 |
| ▸ | GAK | O14976 | 1/20 | 0.40 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | ATR | Q13535 | 1/20 | 0.38 |
| ▸ | ATRIP | Q8WXE1 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | ADK | P55263 | 1/20 | 0.35 |
| ▸ | FLT1 | P17948 | 1/20 | 0.35 |
| ▸ | FLT4 | P35916 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL8664432 | 0.80 | LMNA (0.47) | ARPRKDCALDH1A1MAPTHTT | |
| SCHEMBL8663602 | 0.78 | AR (0.48) | ARPRKDCPIK3CAPIK3CBPIK3CD | |
| SCHEMBL8664979 | 0.78 | NPC1 (0.48) | PRKDCPIK3CAPIK3CBPIK3CDPIK3CG | |
| SCHEMBL31025635 | 0.70 | AR (0.55) | ARPRKDCPIK3CAPIK3CBPIK3CD | |
| SCHEMBL1310274 | 0.66 | PIK3CA (0.59) | ARPRKDCPIK3CAPIK3CBPIK3CD | |
| SCHEMBL27743819 | 0.66 | LMNA (0.52) | ARPRKDCPIK3CAPIK3CBPIK3CG | |
| SCHEMBL2879730 | 0.64 | AR (0.48) | ARPRKDCPIK3CAPIK3CBPIK3CG | |
| SCHEMBL17009413 | 0.64 | AR (1.00) | ARMEN1NPC1ALDH1A1MAPT | |
| SCHEMBL31060119 | 0.64 | PRKDC (1.00) | PRKDCPIK3CAPIK3CBPIK3CDPIK3CG | |
| SCHEMBL8662677 | 0.63 | PIK3CA (0.47) | PRKDCPIK3CAPIK3CBPIK3CDPIK3CG |
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-5852006-A | N-aminoalkyl-substituted nitrogen-containing six membered heterocyclic compounds | NIPPON CHEMIPHAR CO., LTD. (JP) | 1998-12-22 | — | — | US | disclosed |
| US-5574030-A | INHIBITING URINARY CONTRACTION, HETEROCYCLIC DIAMINES | NIPPON CHEMIPHAR CO., LTD. (JP) | 1996-11-12 | — | — | US | disclosed |