Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPRT1 | P00492 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | NQO2 | P16083 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.41 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL598995 | 1.00 | HPRT1 (0.54) | HPRT1ALDH1A1CYP2A6TSHRHSD17B10 | |
| SCHEMBL285473 | 0.89 | HPRT1 (0.50) | HPRT1ALDH1A1CYP2A6TSHRHSD17B10 | |
| SCHEMBL3801506 | 0.89 | HPRT1 (0.50) | HPRT1ALDH1A1CYP2A6TSHRHSD17B10 | |
| SCHEMBL66918 | 0.88 | CYP1A2 (0.55) | TDP1ATMCYP1A2CYP2C19CYP2D6 | |
| SCHEMBL1023164 | 0.87 | HPRT1 (0.48) | HPRT1ALDH1A1CYP2A6TSHRHSD17B10 | |
| SCHEMBL19433085 | 0.87 | HPRT1 (0.48) | HPRT1ALDH1A1CYP2A6TSHRHSD17B10 | |
| SCHEMBL28452662 | 0.86 | LIPG (0.49) | HPRT1ALDH1A1TDP1CYP1A2CYP2C19 | |
| SCHEMBL9621111 | 0.86 | LIPG (0.49) | HPRT1ALDH1A1TDP1CYP1A2CYP2C19 | |
| SCHEMBL9764124 | 0.86 | LIPG (0.49) | HPRT1ALDH1A1TDP1CYP1A2CYP2C19 | |
| SCHEMBL2577637 | 0.86 | LIPG (0.49) | HPRT1ALDH1A1TDP1CYP1A2CYP2C19 |
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-4039793-A | PRODUCTION OF MONOCHLORO- AND ARYL SUBSTITUTED SATURATED COMPOUNDS | UOP INC. (US) | 1977-08-02 | — | — | US | disclosed |