Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 8/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | GALR3 | O60755 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | GRN | P28799 | 1/20 | 0.33 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL4639434 | 0.88 | CYP19A1 (0.42) | CYP19A1ALDH1A1TSHRNR1I3SMN1; SMN2 | |
| SCHEMBL4638527 | 0.85 | USP2 (0.41) | CYP19A1ALDH1A1TSHRPOLBSMN1; SMN2 | |
| SCHEMBL4639451 | 0.82 | CYP19A1 (0.48) | CYP19A1ALDH1A1TSHRPOLBSMN1; SMN2 | |
| SCHEMBL4637778 | 0.81 | CYP19A1 (0.68) | CYP19A1POLBSMN1; SMN2CYP1A2CYP2C9 | |
| SCHEMBL4638842 | 0.76 | CYP19A1 (0.48) | CYP19A1ALDH1A1TSHRPOLB | |
| SCHEMBL4638983 | 0.75 | IDH1 (0.49) | CYP19A1ALDH1A1TSHRCYP3A4HIF1A | |
| SCHEMBL4637975 | 0.75 | CYP19A1 (0.39) | CYP19A1ALDH1A1TSHRNR1I3P2RX7 | |
| SCHEMBL4637771 | 0.74 | IDH1 (0.42) | CYP19A1ALDH1A1 | |
| SCHEMBL4637971 | 0.73 | CYP19A1 (0.50) | CYP19A1ALDH1A1TSHRSMN1; SMN2CYP1A2 | |
| SCHEMBL4637737 | 0.73 | HSP90AA1 (0.38) | CYP19A1ALDH1A1TSHRSMN1; SMN2CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1501808-B1 | TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-07-02 | — | — | EP | disclosed |