Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.44 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.44 |
| ▸ | NQO2 | P16083 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6754477 | 0.83 | CYP1A2 (0.44) | SIGMAR1KMT2ACYP1A2CYP2C19CYP2D6 | |
| SCHEMBL3003489 | 0.82 | SIGMAR1 (0.50) | SIGMAR1CYP1A2CYP2C19CYP2D6TDP1 | |
| SCHEMBL2845252 | 0.82 | ESR1 (0.50) | SIGMAR1KMT2ACYP1A2CYP2C19CYP2D6 | |
| Ammonia Solution, Strong SCHEMBL11816347 | 0.80 | ESR1 (0.49) | SIGMAR1KMT2ACYP1A2CYP2C19CYP2D6 | |
| SCHEMBL8100043 | 0.80 | SIGMAR1 (0.49) | SIGMAR1KMT2ANQO2 | |
| SCHEMBL30849686 | 0.79 | TDP1 (0.47) | SIGMAR1KMT2ACYP1A2CYP2C19RIPK1 | |
| SCHEMBL8329891 | 0.79 | MTNR1A (0.44) | SIGMAR1CYP1A2CYP2C19CYP2D6SLC18A2 | |
| SCHEMBL10484168 | 0.79 | CYP1A2 (0.49) | SIGMAR1KMT2ACYP1A2CYP2C19CYP2D6 | |
| SCHEMBL4819780 | 0.79 | CYP1A2 (0.47) | SIGMAR1KMT2ACYP1A2CYP2C19CYP2D6 | |
| SCHEMBL2480671 | 0.79 | KMT2A (0.51) | SIGMAR1KMT2ACYP1A2CYP2C19CYP2D6 |
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-5025048-A | Oxygen resistant, storage-stable curable polysiloxanes hydrosilated by a polycyclic polyene and a compound containing an amine and a hydroxy, both sterically hindered | HERCULES INCORPORATED (US) | 1991-06-18 | — | — | US | disclosed |