Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.59 |
| ▸ | ATM | Q13315 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.56 |
| ▸ | CA2 | P00918 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | BLM | P54132 | 1/20 | 0.53 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.53 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.51 |
| ▸ | STAT3 | P40763 | 1/20 | 0.50 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.50 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL11811187 | 0.91 | CALM1 (0.58) | CYP19A1ATMKDM4EABCB1CA2 | |
| SCHEMBL16641094 | 0.84 | CYP19A1 (0.77) | CYP19A1ATMKDM4EABCB1CA2 | |
| SCHEMBL31157848 | 0.84 | CYP19A1 (0.77) | CYP19A1ATMKDM4EABCB1CA2 | |
| SCHEMBL10335393 | 0.82 | CYP19A1 (0.81) | CYP19A1ATMKDM4EABCB1CA2 | |
| SCHEMBL11806673 | 0.82 | TRAP1 (0.56) | CYP19A1ABCB1ABCG2 | |
| SCHEMBL25142680 | 0.81 | CYP19A1 (0.57) | CYP19A1ATMKDM4EABCB1CA2 | |
| SCHEMBL22381404 | 0.81 | TAAR1 (0.59) | CYP19A1ATMKDM4EABCB1SMN1; SMN2 | |
| SCHEMBL16181214 | 0.77 | CA2 (0.63) | CYP19A1ATMKDM4ECA2POLB | |
| SCHEMBL11812353 | 0.77 | TAAR1 (0.62) | CA2AOC3 | |
| SCHEMBL7319619 | 0.77 | ATM (0.66) | CYP19A1ATMKDM4ECA2POLB |
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 |
|---|---|---|---|---|---|---|---|
| US-3950236-A | OXIDATION, ALKYL-ALKOXY-BIBENZYL COMPOUNDS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF HEALTH, EDUCATION AND WELFARE (US) | 1976-04-13 | — | — | US | claimed |
| US-3950236-A | OXIDATION, ALKYL-ALKOXY-BIBENZYL COMPOUNDS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF HEALTH, EDUCATION AND WELFARE (US) | 1976-04-13 | — | — | US | disclosed |