Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 3/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8780440 | 0.94 | ALDH1A1 (0.50) | ALDH1A1KMT2ACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL11616199 | 0.94 | ALDH1A1 (0.54) | ALDH1A1KMT2ACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL11617138 | 0.89 | KMT2A (0.52) | ALDH1A1KMT2ACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL11616203 | 0.88 | ALDH1A1 (0.51) | ALDH1A1KMT2ACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL8780424 | 0.85 | ALDH1A1 (0.57) | ALDH1A1KMT2ACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL11615957 | 0.84 | POLB (0.50) | ALDH1A1KMT2ACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL11618944 | 0.84 | ALDH1A1 (0.54) | ALDH1A1KMT2ACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL11617140 | 0.83 | KMT2A (0.49) | ALDH1A1KMT2ACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL11375069 | 0.81 | KMT2A (0.52) | ALDH1A1KMT2ACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL20827130 | 0.80 | GPR35 (0.60) | ALDH1A1KMT2ACYP1A2CYP3A4CYP2C19 |
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-4107310-A | ANALGESICS | ROUSSEL UCLAF (FR) | 1978-08-15 | — | — | US | disclosed |