Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPRT1 | P00492 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.44 |
| ▸ | BAD | Q92934 | 1/20 | 0.44 |
| ▸ | HSD17B1 | P14061 | 6/20 | 0.40 |
| ▸ | HSD17B2 | P37059 | 6/20 | 0.40 |
| ▸ | NQO1 | P15559 | 3/20 | 0.40 |
| ▸ | PNMT | P11086 | 1/20 | 0.39 |
| ▸ | KIF11 | P52732 | 1/20 | 0.37 |
| ▸ | PLAU | P00749 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 2/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| 1-Naphthol SCHEMBL27430537 | 0.91 | CYP1A2 (0.46) | HPRT1CYP1A2BCL2L1BADHSD17B1 | |
| SCHEMBL27772008 | 0.86 | HPRT1 (0.47) | HPRT1BCL2L1BADNQO1KIF11 | |
| 1-Naphthol SCHEMBL27427628 | 0.85 | CYP1A2 (0.52) | HPRT1CYP1A2BCL2L1BADNQO1 | |
| 1-Naphthol SCHEMBL27573059 | 0.84 | CYP1A2 (0.45) | CYP1A2BCL2L1BADHSD17B1HSD17B2 | |
| Betanaphthol SCHEMBL27451711 | 0.83 | HPRT1 (0.45) | HPRT1CYP1A2BCL2L1BADNQO1 | |
| 1-Naphthol SCHEMBL27480387 | 0.82 | CYP1A2 (0.42) | HPRT1CYP1A2BCL2L1BADHSD17B1 | |
| SCHEMBL27563500 | 0.82 | BCL2L1 (0.50) | HPRT1CYP1A2BCL2L1BADNQO1 | |
| SCHEMBL27532014 | 0.78 | BCL2L1 (0.60) | CYP1A2BCL2L1BADNQO1PNMT | |
| Quinoline SCHEMBL28793169 | 0.77 | ALDH1A1 (0.42) | HPRT1CYP1A2KIF11ALDH1A1 | |
| SCHEMBL30662035 | 0.77 | BCL2L1 (0.48) | BCL2L1BADNQO1PNMTKIF11 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1113874-C | Benzocycloalkylazolethione derivatives | SYNTEX INC (US) | 2003-07-09 | — | — | CN | disclosed |
| CN-1151735-A | Benzocycloalkylazolethione derivatives | SYNTEX INC (US) | 1997-06-11 | — | — | CN | disclosed |