Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | GFER | P55789 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL3864255 | 0.85 | ALDH1A1 (0.57) | ALDH1A1KMT2ALMNAMEN1GAA | |
| SCHEMBL4541169 | 0.83 | ALDH1A1 (0.73) | ALDH1A1KMT2ALMNAMEN1MAPT | |
| SCHEMBL19346235 | 0.78 | ALDH1A1 (0.69) | ALDH1A1KMT2ALMNACYP3A4CYP2C9 | |
| SCHEMBL3898275 | 0.77 | LMNA (0.72) | ALDH1A1LMNAPKMCA2 | |
| SCHEMBL9131405 | 0.75 | POLB (0.79) | ALDH1A1KMT2ARAB9ALMNAPOLB | |
| SCHEMBL6279910 | 0.75 | EGFR (0.56) | ALDH1A1KMT2ARAB9ALMNAPOLB | |
| SCHEMBL9871290 | 0.75 | ALDH1A1 (0.75) | ALDH1A1RAB9ALMNAPKM | |
| SCHEMBL600045 | 0.75 | ALDH1A1 (0.75) | ALDH1A1RAB9ALMNAPKM | |
| SCHEMBL11399643 | 0.74 | ALDH1A1 (0.57) | ALDH1A1KMT2ARAB9ALMNAPOLB | |
| SCHEMBL7627224 | 0.74 | ALDH1A1 (0.72) | ALDH1A1KMT2ARAB9ALMNAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1040098-A1 | INTEGRIN RECEPTOR ANTAGONISTS | Merck & Co., Inc. (a New Jersey corp.) (US) | 2000-10-04 | — | — | EP | disclosed |
| WO-1999031061-A1 | INTEGRIN RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 1999-06-24 | — | — | WO | disclosed |