Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.79 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.74 |
| ▸ | HPGD | P15428 | 4/20 | 0.64 |
| ▸ | PHGDH | O43175 | 1/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | USP2 | O75604 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.54 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL4696938 | 0.93 | HPGD (0.72) | TSHRAKR1C3HPGDPHGDHALDH1A1 | |
| SCHEMBL10720943 | 0.86 | PHGDH (0.81) | TSHRAKR1C3HPGDPHGDHALDH1A1 | |
| SCHEMBL9133746 | 0.84 | ALDH1A1 (0.64) | TSHRHPGDALDH1A1SMN1; SMN2MAPK1 | |
| SCHEMBL946143 | 0.80 | HPGD (0.86) | TSHRAKR1C3HPGDPHGDHALDH1A1 | |
| SCHEMBL28296651 | 0.80 | HPGD (0.86) | TSHRAKR1C3HPGDPHGDHALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL6028542 | 0.79 | HPGD (0.83) | TSHRAKR1C3HPGDPHGDHALDH1A1 | |
| SCHEMBL2199279 | 0.79 | PHGDH (0.71) | TSHRAKR1C3HPGDPHGDHALDH1A1 | |
| SCHEMBL30449295 | 0.79 | HPGD (0.83) | TSHRAKR1C3HPGDPHGDHALDH1A1 | |
| SCHEMBL8150805 | 0.78 | HPGD (0.76) | TSHRHPGDPHGDHALDH1A1SMN1; SMN2 | |
| SCHEMBL27045664 | 0.78 | HPGD (1.00) | TSHRAKR1C3HPGDPHGDHALDH1A1 |
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-6265381-B1 | MORPHOLINOUREA AND RELATED DERIVATIVES OF PENTAFLUOROETHYL PEPTIDES | MERRELL PHARMACEUTICALS, INC. | 2001-07-24 | — | — | US | disclosed |