Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | CCNC | P24863 | 1/20 | 0.42 |
| ▸ | CDK8 | P49336 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.38 |
| ▸ | ACR | P10323 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 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 | |
|---|---|---|---|---|
| SCHEMBL10551354 | 0.94 | PRSS1 (0.44) | KMT2ACCNCCDK8MAPTTHRB | |
| SCHEMBL10550392 | 0.93 | KMT2A (0.43) | KMT2ACCNCCDK8MAPTTHRB | |
| SCHEMBL10549689 | 0.93 | KMT2A (0.44) | KMT2AMAPTLMNACYP2C9PRSS1 | |
| SCHEMBL10550390 | 0.93 | KMT2A (0.49) | KMT2AMAPTTHRBLMNACYP2C9 | |
| SCHEMBL10557318 | 0.90 | MAPT (0.44) | KMT2AMAPTLMNACYP2C9PRSS1 | |
| SCHEMBL10553143 | 0.90 | CYP2C9 (0.40) | KMT2AMAPTTHRBLMNACYP2C9 | |
| SCHEMBL10552327 | 0.89 | MGLL (0.38) | KMT2AMAPTLMNACYP2C9PRSS1 | |
| SCHEMBL10554555 | 0.88 | PRSS1 (0.50) | KMT2AMAPTTHRBLMNACYP2C9 | |
| SCHEMBL10552477 | 0.88 | THRB (0.43) | KMT2AMAPTTHRBLMNACYP2C9 | |
| SCHEMBL10551185 | 0.87 | LMNA (0.49) | KMT2AMAPTTHRBLMNACYP2C9 |
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-4846998-A | LIQUID CRYSTALS, ESTERS, NITRILES; ETHERS, HYDROCARBONS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1989-07-11 | — | — | US | disclosed |