Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | PPID | Q08752 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP21A2 | P08686 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | TBXAS1 | P24557 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MITF | O75030 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18631522 | 0.82 | L3MBTL1 (0.38) | CYP17A1MAPT | |
| SCHEMBL17285650 | 0.79 | ALDH1A1 (0.35) | ALDH1A1LMNACYP3A4TBXAS1SMN1; SMN2 | |
| SCHEMBL6808774 | 0.79 | KMT2A (0.41) | ALDH1A1MAPTKMT2AHTT | |
| SCHEMBL21039172 | 0.77 | ALDH1A1 (0.36) | ALDH1A1TBXAS1SMN1; SMN2MAPT | |
| SCHEMBL8872429 | 0.77 | ALDH1A1 (0.44) | ALDH1A1TBXAS1MAPT | |
| SCHEMBL217356 | 0.77 | ALDH1A1 (0.42) | ALDH1A1LMNATBXAS1KDM4ETSHR | |
| SCHEMBL5257422 | 0.76 | QPCT (0.45) | ALDH1A1LMNAGAASMN1; SMN2MEN1 | |
| SCHEMBL17517848 | 0.75 | TBXAS1 (0.48) | ALDH1A1GAATBXAS1KDM4ETSHR | |
| SCHEMBL10407622 | 0.75 | TBXAS1 (0.45) | ALDH1A1LMNAGAATBXAS1KDM4E | |
| SCHEMBL12150031 | 0.75 | CYP26A1 (0.40) | ALDH1A1TBXAS1KDM4ESMN1; SMN2MAPT |
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-5610144-A | CHOLECYSTOKININ OR GASTRIN ANTAGONISTS; NERVOUS SYSTEM AND GASTROINTESTINAL DISORDERS | RHONE-POULENC RORER S.A. (FR) | 1997-03-11 | — | — | US | disclosed |