Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PHGDH | O43175 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | FAAH | O00519 | 1/20 | 0.44 |
| ▸ | MGLL | Q99685 | 1/20 | 0.44 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3386455 | 0.85 | HPGD (0.46) | HPGDTSHRSMN1; SMN2GAARAB9A | |
| SCHEMBL5949372 | 0.72 | PHGDH (0.54) | PHGDHHPGDTSHRSMN1; SMN2GAA | |
| SCHEMBL21498000 | 0.71 | MAPT (0.47) | PHGDHHPGDTSHRSMN1; SMN2GAA | |
| SCHEMBL5342293 | 0.71 | PHGDH (0.58) | PHGDHHPGDTSHRSMN1; SMN2GAA | |
| SCHEMBL8727982 | 0.71 | MGLL (0.59) | PHGDHHPGDTSHRSMN1; SMN2GAA | |
| SCHEMBL8883608 | 0.70 | FKBP1A (0.48) | PHGDHHPGDTSHRSMN1; SMN2GAA | |
| Morpholino(Phenyl)Methanethione SCHEMBL9180076 | 0.70 | MGLL (0.79) | PHGDHHPGDTSHRSMN1; SMN2FAAH | |
| SCHEMBL8992020 | 0.69 | PHGDH (0.51) | PHGDHHPGDTSHRSMN1; SMN2GAA | |
| SCHEMBL8992021 | 0.69 | PHGDH (0.51) | PHGDHHPGDTSHRSMN1; SMN2GAA | |
| SCHEMBL10420577 | 0.69 | PHGDH (0.51) | PHGDHHPGDTSHRSMN1; SMN2GAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0434365-A2 | HIV protease inhibitors useful for the treatment of aids | MERCK & CO. INC. (US) | 1991-06-26 | — | — | EP | claimed |