Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | CYSLTR2 | Q9NS75 | 3/20 | 0.50 |
| ▸ | CYSLTR1 | Q9Y271 | 3/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.44 |
| ▸ | TRPM2 | O94759 | 1/20 | 0.44 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.44 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.44 |
| ▸ | SLC16A3 | O15427 | 4/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | THRA | P10827 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL9685604 | 1.00 | HPGD (0.51) | HPGDCYSLTR2CYSLTR1CYP1A2NPSR1 | |
| SCHEMBL12529039 | 0.85 | HPGD (0.59) | HPGDCYP1A2NPSR1POLBACHE | |
| SCHEMBL951304 | 0.85 | HPGD (0.59) | HPGDCYP1A2NPSR1POLBACHE | |
| SCHEMBL951306 | 0.85 | HPGD (0.59) | HPGDCYP1A2NPSR1POLBACHE | |
| SCHEMBL28738658 | 0.83 | THRA (0.56) | CYSLTR2CYSLTR1POLBTRPA1TRPM2 | |
| SCHEMBL27909138 | 0.82 | THRA (0.58) | CYSLTR2CYSLTR1POLBTRPA1TRPM2 | |
| SCHEMBL28857119 | 0.81 | THRA (0.57) | CYSLTR2CYSLTR1POLBTRPA1TRPM2 | |
| SCHEMBL28955038 | 0.81 | THRA (0.57) | CYSLTR2CYSLTR1POLBTRPA1TRPM2 | |
| SCHEMBL28857062 | 0.81 | THRA (0.57) | CYSLTR2CYSLTR1POLBTRPA1TRPM2 | |
| SCHEMBL28857160 | 0.81 | THRA (0.57) | CYSLTR2CYSLTR1POLBTRPA1TRPM2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0245053-B1 | HETEROCYCLIC FUSED TRICYCLIC COMPOUNDS | ICI AMERICAS INC. (US) | 1992-11-25 | — | — | EP | disclosed |
| US-5118688-A | TETRAHYDROPYRIDOQUINOLONE DERIVATIVES USEFUL AS ANXIOLYTIC AGENTS | ICI AMERICAS INC. (US) | 1992-06-02 | — | — | US | disclosed |
| US-4975435-A | Certain 1H-pyrrold[3,4-b]quinolin-1-one-9-amino-2,3-dihydro derivatives useful for treating anxiety | ICI AMERICAS INC. (US) | 1990-12-04 | — | — | US | disclosed |
| EP-0245053-A1 | Heterocyclic fused tricyclic compounds | ICI AMERICAS INC. (US) | 1987-11-11 | — | — | EP | disclosed |