Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 2/20 | 0.40 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.39 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | GRM2 | Q14416 | 3/20 | 0.36 |
| ▸ | GRM3 | Q14832 | 3/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | GRM6 | O15303 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11276596 | 0.96 | DDB1 (0.40) | SMN1; SMN2KMT2ACTSKDDB1CRBN | |
| SCHEMBL6380145 | 0.72 | FKBP1A (0.47) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL11354037 | 0.70 | DDB1 (0.39) | KMT2ADDB1CRBNHPGDGRM2 | |
| SCHEMBL10722403 | 0.70 | MAOA (0.42) | AKR1C1 | |
| Hydrochloric Acid SCHEMBL1809435 | 0.70 | ARG1 (0.48) | EPHX1HPGDGRM2GRM3GRM6 | |
| SCHEMBL11279027 | 0.69 | HPGD (0.40) | KMT2ADDB1CRBNEPHX1HPGD | |
| SCHEMBL6271170 | 0.69 | TAAR1 (0.37) | SMN1; SMN2KMT2AEPHX1HPGDEPHX2 | |
| SCHEMBL8902170 | 0.69 | GRM2 (0.67) | GRM2GRM3GRM6 | |
| SCHEMBL940436 | 0.69 | GAA (0.44) | SMN1; SMN2KMT2ADDB1CRBNHPGD | |
| Hydrochloric Acid SCHEMBL2712564 | 0.69 | MAOA (0.43) | AKR1C1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4315031-A | Thiosubstituted amino acids | SCIENCE UNION ET CIE (FR) | 1982-02-09 | — | — | US | claimed |
| EP-0001193-B1 | CARBOCYLIC AMINO ACIDS, METHODS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SCIENCE UNION ET Cie SOCIETE FRANCAISE DE RECHERCHE MEDICALE (FR) | 1981-10-14 | — | — | EP | claimed |
| US-4315031-A | Thiosubstituted amino acids | SCIENCE UNION ET CIE (FR) | 1982-02-09 | — | — | US | disclosed |