Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | RAD52 | P43351 | 1/20 | 0.31 |
| ▸ | LTA4H | P09960 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3151329 | 0.86 | TDP1 (0.37) | HTTTDP1TSHRALDH1A1RECQL | |
| SCHEMBL20921242 | 0.81 | CYP3A4 (0.38) | TDP1ALDH1A1 | |
| SCHEMBL1314975 | 0.81 | CYP3A4 (0.38) | TDP1ALDH1A1 | |
| SCHEMBL4682113 | 0.79 | — | — | |
| SCHEMBL14587441 | 0.78 | KCNA3 (0.30) | — | |
| SCHEMBL779932 | 0.78 | CES2 (0.37) | HTTTDP1TSHRLTA4H | |
| SCHEMBL7329423 | 0.78 | — | — | |
| SCHEMBL9760714 | 0.78 | CES2 (0.37) | HTTTDP1TSHRLTA4H | |
| SCHEMBL30828004 | 0.78 | CES2 (0.37) | HTTTDP1TSHRLTA4H | |
| SCHEMBL19403477 | 0.78 | CES2 (0.37) | HTTTDP1TSHRLTA4H |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992019231-A1 | PHARMACEUTICAL COMPOSITION COMPRISING AN INHIBITOR OF ALCOHOL DEHYDROGENASE | LEO PHARMACEUTICAL PRODUCTS LTD. A/S (DK) | 1992-11-12 | — | — | WO | disclosed |
| US-4388326-A | TREATMENT OF ALCOHOLISM | MERCK & CO., INC. (US) | 1983-06-14 | — | — | US | disclosed |