Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | CA12 | O43570 | 3/20 | 0.44 |
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | CA2 | P00918 | 3/20 | 0.44 |
| ▸ | CA7 | P43166 | 3/20 | 0.44 |
| ▸ | CA9 | Q16790 | 3/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.41 |
| ▸ | ELANE | P08246 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | SLC2A1 | P11166 | 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 | |
|---|---|---|---|---|
| SCHEMBL11271239 | 0.90 | GPR35 (0.47) | AKR1B1NPC1RAB9ACA12CA2 | |
| SCHEMBL11261990 | 0.86 | MAOB (0.44) | AKR1B1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL11269705 | 0.82 | MAPT (0.41) | AKR1B1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL11280577 | 0.81 | AKR1B1 (0.43) | AKR1B1NPC1RAB9ACA12CA1 | |
| SCHEMBL11270952 | 0.81 | NPC1 (0.43) | AKR1B1NPC1RAB9AESR1ESR2 | |
| SCHEMBL11275408 | 0.79 | HPGD (0.45) | AKR1B1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL28437380 | 0.77 | NPC1 (0.50) | AKR1B1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL15143796 | 0.73 | MAOB (0.49) | AKR1B1NPC1CA12CA1CA2 | |
| SCHEMBL11274526 | 0.72 | MAPT (0.49) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL9665289 | 0.71 | NPC1 (0.49) | NPC1RAB9AMAPT |
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-4364956-A | ASTHMA | LILLY INDUSTRIES LIMITED (GB) | 1982-12-21 | — | — | US | disclosed |