Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | THRB | P10828 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 5/20 | 0.44 |
| ▸ | CA1 | P00915 | 5/20 | 0.44 |
| ▸ | CA2 | P00918 | 5/20 | 0.44 |
| ▸ | CA9 | Q16790 | 5/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CCR10 | P46092 | 2/20 | 0.33 |
| ▸ | TYMP | P19971 | 3/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8432206 | 0.84 | LMNA (0.65) | LMNATHRBCYP2C19CYP3A4CYP2D6 | |
| SCHEMBL4654768 | 0.81 | CYP2C19 (0.62) | LMNATHRBCYP2C19CYP3A4CYP2D6 | |
| SCHEMBL5312329 | 0.74 | LMNA (0.70) | LMNATHRBCYP2C19CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL6131638 | 0.72 | LMNA (0.60) | LMNATHRBCYP2C19CYP3A4CYP2D6 | |
| SCHEMBL8483856 | 0.71 | LMNA (0.58) | LMNATHRBCYP2C19CYP3A4CYP2D6 | |
| Potassium Ion SCHEMBL5317511 | 0.70 | LMNA (0.68) | LMNATHRBCYP2C19CYP3A4CYP2D6 | |
| SCHEMBL15024639 | 0.69 | LMNA (0.80) | LMNATHRBCYP2C19CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL6131639 | 0.69 | LMNA (0.56) | LMNATHRBCYP2C19CYP3A4CYP2D6 | |
| SCHEMBL6131592 | 0.69 | CYP2C19 (0.53) | LMNATHRBCYP2C19CYP3A4CYP2D6 | |
| SCHEMBL14499615 | 0.69 | LMNA (0.78) | LMNATHRBCYP2C19CYP3A4CYP2D6 |
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-5932707-A | Thioether-containing metal chelating compounds | NYCOMED AMERSHAM PLC (GB) | 1999-08-03 | — | — | US | disclosed |