Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.36 |
| ▸ | CCR2 | P41597 | 7/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL14383469 | 0.77 | ALDH1A1 (0.34) | HPGDMEN1KMT2AALDH1A1CYP2C19 | |
| SCHEMBL18700221 | 0.75 | TAAR1 (0.33) | HPGDMEN1KMT2AALDH1A1CYP2C19 | |
| SCHEMBL3787206 | 0.73 | CCR2 (0.46) | HPGDMEN1KMT2AALDH1A1CYP2C19 | |
| SCHEMBL22932069 | 0.73 | CRHR1 (0.38) | ALDH1A1HTTHIF1ACRHR1 | |
| SCHEMBL19250282 | 0.73 | ALDH1A1 (0.36) | HPGDMEN1KMT2AALDH1A1CYP2C19 | |
| SCHEMBL22044297 | 0.73 | TRPA1 (0.35) | MEN1KMT2AALDH1A1ALOX15HTT | |
| SCHEMBL12432698 | 0.72 | HDAC1 (0.38) | HPGDMEN1KMT2AALDH1A1HSP90AA1 | |
| SCHEMBL1145559 | 0.72 | TP53 (0.48) | HPGDMEN1KMT2AALDH1A1CYP2C19 | |
| SCHEMBL18850253 | 0.70 | CCR2 (0.46) | HPGDMEN1KMT2AALDH1A1CYP2C19 | |
| SCHEMBL8492853 | 0.70 | CYP3A4 (0.48) | HPGDMEN1KMT2AALDH1A1CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-10336938-B2 | Liquid crystal composition | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2019-07-02 | — | — | US | disclosed |
| US-20170283700-A1 | LIQUID CRYSTAL COMPOSITION | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2017-10-05 | — | — | US | disclosed |
| EP-2287161-B1 | Derivatives of 4-piperazin-1-yl-4-benzo[b]thiophene suitable for the treatment of CNS disorders | OTSUKA PHARMA CO LTD (JP) | 2012-05-09 | — | — | EP | disclosed |