Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | GAA | P10253 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4735120 | 0.74 | HTT (0.56) | HTTSLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL14344856 | 0.74 | HTT (0.56) | HTTSLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL30530619 | 0.74 | HTT (0.89) | HTTALDH1A1HPGDCYP3A4CYP2C9 | |
| SCHEMBL1520613 | 0.74 | HTT (0.89) | HTTALDH1A1HPGDCYP3A4CYP2C9 | |
| SCHEMBL2108565 | 0.74 | HPGD (0.53) | HTTSLC6A2SLC6A3ALDH1A1HPGD | |
| SCHEMBL2538595 | 0.73 | HTT (0.86) | HTTALDH1A1HPGDCYP3A4CYP2C9 | |
| SCHEMBL10330512 | 0.73 | HTT (0.86) | HTTALDH1A1HPGDCYP3A4CYP2C9 | |
| SCHEMBL14344766 | 0.70 | HTT (0.61) | HTTSLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL13162411 | 0.70 | HTT (0.96) | HTTALDH1A1HPGDCYP3A4CYP2C9 | |
| SCHEMBL14825166 | 0.69 | HTT (1.00) | HTTALDH1A1HPGDCYP3A4CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1294695-A2 | SUBSTITUTED DIAMIDE DERIVATIVES USEFUL AS MOTILIN ANTAGONISTS | Ortho-McNeil Pharmaceutical, Inc. (US) | 2003-03-26 | — | — | EP | claimed |
| WO-2001085694-A2 | SUBSTITUTED DIAMIDE DERIVATIVES USEFUL AS MOTILIN ANTAGONISTS | ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) | 2001-11-15 | — | — | WO | claimed |