Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.47 |
| ▸ | CA2 | P00918 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.43 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.43 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.41 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5251870 | 0.79 | CYP1A2 (0.54) | CA1CA2ALDH1A1KDM4ECYP1A2 | |
| SCHEMBL646163 | 0.77 | CA1 (0.52) | CA1CA2ALDH1A1KDM4ECYP1A2 | |
| SCHEMBL6235233 | 0.75 | ALDH1A1 (0.45) | CA1CA2ALDH1A1KDM4ECYP1A2 | |
| SCHEMBL50873 | 0.75 | ALDH1A1 (0.45) | CA1CA2ALDH1A1KDM4ECYP1A2 | |
| SCHEMBL8331897 | 0.75 | CYP2A6 (0.54) | CA1CA2ALDH1A1KDM4ECYP1A2 | |
| SCHEMBL1392608 | 0.75 | ALDH1A1 (0.45) | CA1CA2ALDH1A1KDM4ECYP1A2 | |
| SCHEMBL5251868 | 0.75 | ALDH1A1 (0.48) | CA1CA2ALDH1A1KDM4ECYP1A2 | |
| SCHEMBL1855575 | 0.75 | ESR1 (0.54) | CA1CA2ALDH1A1KDM4ECYP1A2 | |
| SCHEMBL2419451 | 0.75 | ALDH1A1 (0.46) | CA1CA2ALDH1A1KDM4ECYP1A2 | |
| SCHEMBL16936582 | 0.75 | ALDH1A1 (0.45) | CA1CA2ALDH1A1KDM4ECYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5629406-A | AMINO ACID DERIVATIVES | SANKYO COMPANY, LIMITED (JP) | 1997-05-13 | — | — | US | disclosed |
| EP-0587311-A1 | Peptides capable of inhibiting the activity of HIV protease, their preparation and their therapeutic use | SANKYO COMPANY LIMITED (JP) | 1994-03-16 | — | — | EP | disclosed |