Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 5/20 | 1.00 |
| ▸ | CALM1 | P0DP23 | 4/20 | 0.62 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.58 |
| ▸ | GFER | P55789 | 1/20 | 0.56 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | NQO2 | P16083 | 1/20 | 0.52 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.50 |
| ▸ | TUBB | P07437 | 1/20 | 0.50 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.50 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.50 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.50 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.50 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.50 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.50 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.50 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.50 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.50 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9827015 | 0.98 | CYP19A1 (0.96) | CYP19A1CALM1AKR1B1GFERTAAR1 | |
| SCHEMBL8746062 | 0.85 | CYP19A1 (0.74) | CYP19A1CALM1GFERTAAR1TDP1 | |
| SCHEMBL28891744 | 0.85 | CALM1 (0.75) | CYP19A1CALM1AKR1B1TAAR1TUBB4A | |
| SCHEMBL3364226 | 0.83 | CYP19A1 (0.71) | CYP19A1TAAR1ALDH1A1CYP3A4MAOB | |
| SCHEMBL9491787 | 0.82 | CYP19A1 (0.68) | CYP19A1CALM1AKR1B1TAAR1TUBB4A | |
| SCHEMBL24080182 | 0.80 | CYP19A1 (0.67) | CYP19A1GFERTDP1ALDH1A1CYP3A4 | |
| SCHEMBL4735081 | 0.80 | CALM1 (0.73) | CYP19A1CALM1AKR1B1GFERMAPK1 | |
| SCHEMBL19039706 | 0.80 | CYP19A1 (0.67) | CYP19A1CALM1TAAR1TDP1MAPK1 | |
| SCHEMBL1972535 | 0.79 | CYP19A1 (0.66) | CYP19A1CALM1AKR1B1TAAR1MAPK1 | |
| SCHEMBL153674 | 0.79 | TAAR1 (0.64) | CYP19A1CALM1AKR1B1TAAR1MAPK1 |
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-4939133-A | N-substituted-2-hydroxy-α-oxo-benzeneacetamides and pharmaceutical compositions having activity as modulators of the arachidonic acid cascade | WARNER-LAMBERT COMPANY (US) | 1990-07-03 | — | — | US | disclosed |