Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | GMNN | O75496 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | BLM | P54132 | 2/20 | 0.33 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | CMKLR1 | Q99788 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14141727 | 0.90 | CYP19A1 (0.42) | CYP19A1FFAR1TDP1ALDH1A1LMNA | |
| SCHEMBL210134 | 0.83 | HPGD (0.44) | CYP19A1FFAR1TDP1ALDH1A1LMNA | |
| SCHEMBL11397439 | 0.81 | KEAP1 (0.52) | CYP19A1FFAR1TDP1ALDH1A1MAPT | |
| SCHEMBL936740 | 0.79 | HTT (0.47) | ALDH1A1LMNAMAPTMEN1MAPK1 | |
| SCHEMBL97143 | 0.78 | L3MBTL1 (0.41) | FFAR1TDP1ALDH1A1MAPTNPC1 | |
| SCHEMBL7999608 | 0.78 | ALDH1A1 (0.49) | ALDH1A1LMNAMAPTMEN1MAPK1 | |
| SCHEMBL10787348 | 0.78 | ALDH1A1 (0.49) | ALDH1A1LMNAMAPTMEN1MAPK1 | |
| SCHEMBL1660949 | 0.78 | CYP19A1 (0.69) | CYP19A1FFAR1TDP1ALDH1A1LMNA | |
| SCHEMBL2356747 | 0.78 | ALDH1A1 (0.49) | ALDH1A1LMNAMAPTMEN1MAPK1 | |
| SCHEMBL11069839 | 0.78 | ALDH1A1 (0.49) | ALDH1A1LMNAMAPTMEN1MAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0804419-A1 | QUINOLINE DERIVATIVES AS TACHYKININ NK 3 RECEPTOR ANTAGONISTS | SmithKline Beecham Farmaceutici S.p.A. (IT) | 1997-11-05 | — | — | EP | claimed |
| EP-3704271-A1 | NEUROKININ ANTAGONISTS AND USES THEREOF | California Institute of Technology (US) | 2020-09-09 | — | — | EP | disclosed |
| EP-0804419-A1 | QUINOLINE DERIVATIVES AS TACHYKININ NK 3 RECEPTOR ANTAGONISTS | SmithKline Beecham Farmaceutici S.p.A. (IT) | 1997-11-05 | — | — | EP | disclosed |