Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10813137 | 0.78 | MTNR1B (0.55) | NPC1RAB9AALDH1A1HPGDADRA2A | |
| SCHEMBL6473995 | 0.76 | NPC1 (0.56) | NPC1RAB9AALDH1A1HPGDADRA2A | |
| SCHEMBL6316842 | 0.76 | LMNA (0.56) | NPC1RAB9AALDH1A1HPGDLMNA | |
| SCHEMBL10846698 | 0.75 | KMT2A (0.40) | NPC1RAB9AALDH1A1LMNAMEN1 | |
| SCHEMBL29242619 | 0.74 | RAB9A (0.64) | NPC1RAB9ALMNAPOLBMEN1 | |
| SCHEMBL29974429 | 0.73 | KDM4E (0.43) | NPC1RAB9AALDH1A1HPGDLMNA | |
| SCHEMBL30076309 | 0.73 | MAPK1 (0.40) | ALDH1A1HPGDLMNAKDM4EHSD17B10 | |
| SCHEMBL1067879 | 0.73 | KDM4E (0.43) | NPC1RAB9AALDH1A1HPGDLMNA | |
| SCHEMBL9379650 | 0.72 | NPC1 (0.55) | NPC1RAB9AALDH1A1HPGDKDM4E | |
| Hydrochloric Acid SCHEMBL30668517 | 0.72 | HSP90AB1 (0.35) | ALDH1A1HPGDADRA2ALMNAKDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4599347-A | ANTIULCER AGENTS | HOFFMANN-LA ROCHE INC. (US) | 1986-07-08 | — | — | US | disclosed |