Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | MMP8 | P22894 | 3/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5376593 | 0.88 | LMNA (0.64) | LMNACYP2D6CYP3A4ALDH1A1CYP2C9 | |
| SCHEMBL50034 | 0.73 | TSHR (0.48) | LMNACYP2D6CYP3A4ALDH1A1CYP2C9 | |
| Hydrochloric Acid SCHEMBL8602657 | 0.71 | TSHR (0.46) | LMNACYP2D6CYP3A4ALDH1A1CYP2C9 | |
| Mephentermine SCHEMBL121178 | 0.69 | LMNA (1.00) | LMNACYP2D6CYP3A4ALDH1A1CYP2C9 | |
| SCHEMBL9275889 | 0.68 | LMNA (0.55) | LMNACYP2D6CYP3A4ALDH1A1CYP2C9 | |
| SCHEMBL8613504 | 0.68 | LMNA (0.65) | LMNACYP2D6CYP3A4ALDH1A1CYP2C9 | |
| SCHEMBL20319309 | 0.68 | LMNA (0.42) | LMNACYP2D6CYP3A4ALDH1A1CYP2C9 | |
| Trifluoromethanesulfonic Acid SCHEMBL2334846 | 0.68 | LMNA (0.46) | LMNACYP2D6CYP3A4ALDH1A1CYP2C9 | |
| SCHEMBL5255109 | 0.67 | LMNA (0.59) | LMNACYP2D6CYP3A4ALDH1A1CYP2C9 | |
| SCHEMBL28730004 | 0.67 | MMP8 (0.50) | LMNACYP2D6CYP3A4ALDH1A1CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002017912-A1 | ENDOTHELIN ANTAGONISTS | ABBOTT LABORATORIES (US) | 2002-03-07 | — | — | WO | disclosed |