Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | ACP3 | P15309 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CTSA | P10619 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6054566 | 0.81 | ALDH1A1 (0.44) | ESR1ACP3L3MBTL1ALDH1A1NPC1 | |
| SCHEMBL7674956 | 0.81 | ESR1 (0.43) | ESR1ACP3L3MBTL1ALDH1A1NPC1 | |
| SCHEMBL3964091 | 0.81 | ESR1 (0.43) | ESR1ACP3ALDH1A1NPC1RAB9A | |
| SCHEMBL3888924 | 0.81 | ALDH1A1 (0.44) | ESR1ACP3L3MBTL1ALDH1A1NPC1 | |
| SCHEMBL22917035 | 0.80 | ESR1 (0.46) | ESR1ACP3L3MBTL1ALDH1A1NPC1 | |
| SCHEMBL4370114 | 0.80 | ACP3 (0.48) | ESR1ACP3L3MBTL1ALDH1A1NPC1 | |
| SCHEMBL7515420 | 0.78 | ESR1 (0.45) | ESR1ACP3L3MBTL1ALDH1A1NPC1 | |
| SCHEMBL28127698 | 0.77 | ACP3 (0.46) | ESR1ACP3ALDH1A1TSHRHPGD | |
| SCHEMBL4426947 | 0.76 | ESR1 (0.39) | ESR1ACP3ALDH1A1NPC1RAB9A | |
| SCHEMBL29053314 | 0.76 | ESR1 (0.39) | ESR1ACP3ALDH1A1NPC1RAB9A |
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-6468998-B1 | ANTAGONIZE SEROTONIN 2 RECEPTORS, SUPPRESS PLATELET AGGREGATION, IMPROVE PERIPHERAL CIRCULATION AND PROMOTE LACHRYMATION | MITSUBISHI PHARMA CORPORATION (JP) | 2002-10-22 | — | — | US | disclosed |
| EP-1125922-A1 | PYRROLIDINE COMPOUNDS AND MEDICINAL UTILIZATION THEREOF | Welfide Corporation (JP) | 2001-08-22 | — | — | EP | disclosed |