Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | STK4 | Q13043 | 1/20 | 0.47 |
| ▸ | STK3 | Q13188 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | PRKDC | P78527 | 7/20 | 0.45 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.45 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.45 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
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 | 0.78 | LMNA (0.47) | STK4STK3ALDH1A1PRKDCHSD17B10 | |
| SCHEMBL8663783 | 0.78 | AR (0.47) | NPC1RAB9AMEN1KMT2AALDH1A1 | |
| SCHEMBL8662677 | 0.78 | PIK3CA (0.47) | NPC1RAB9AMEN1KMT2ASTK4 | |
| SCHEMBL28580846 | 0.70 | NPC1 (0.69) | NPC1RAB9AMEN1KMT2AALDH1A1 | |
| SCHEMBL8997929 | 0.70 | NPC1 (0.44) | NPC1RAB9AMEN1KMT2ASTK4 | |
| SCHEMBL8665570 | 0.68 | NPC1 (0.48) | NPC1RAB9AMEN1KMT2ASTK4 | |
| SCHEMBL8665476 | 0.67 | ALDH1A1 (0.43) | NPC1RAB9AMEN1KMT2ASTK4 | |
| SCHEMBL6345668 | 0.67 | HTT (0.52) | NPC1RAB9AMEN1KMT2AALDH1A1 | |
| SCHEMBL31025689 | 0.66 | AR (0.56) | NPC1RAB9AMEN1KMT2AALDH1A1 | |
| SCHEMBL31301668 | 0.64 | STK4 (1.00) | STK4STK3 |
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 |