Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.58 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.37 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | DAO | P14920 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2129236 | 0.86 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2MAPK1TAAR1CYP3A4 | |
| SCHEMBL2130302 | 0.83 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2MAPK1TAAR1CYP3A4 | |
| SCHEMBL29384281 | 0.83 | ALDH1A1 (0.74) | ALDH1A1SMN1; SMN2MAPK1TAAR1CYP3A4 | |
| SCHEMBL473877 | 0.83 | ALDH1A1 (0.74) | ALDH1A1SMN1; SMN2MAPK1TAAR1CYP3A4 | |
| SCHEMBL612852 | 0.80 | SMN1; SMN2 (0.52) | ALDH1A1SMN1; SMN2MAPK1CYP3A4KDM4E | |
| SCHEMBL31644242 | 0.80 | SMN1; SMN2 (0.52) | ALDH1A1SMN1; SMN2MAPK1CYP3A4KDM4E | |
| SCHEMBL2132960 | 0.79 | ALDH1A1 (0.63) | ALDH1A1SMN1; SMN2MAPK1TAAR1CYP3A4 | |
| SCHEMBL11385463 | 0.78 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2MAPK1TAAR1CYP3A4 | |
| Hydrochloric Acid SCHEMBL3758009 | 0.78 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2MAPK1TAAR1CYP3A4 | |
| SCHEMBL25282673 | 0.76 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2MAPK1TAAR1CYP3A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108602805-A | Isoindoline, azaisoindoline, indenone and the dihydro azepine indone inhibitor of MNK1 and MNK2 | 效应治疗股份有限公司 | 2018-09-28 | — | — | CN | disclosed |
| CN-105722838-B | Selective inhibitors of phosphatidylinositol 3-kinase-gamma | 沃泰克斯药物股份有限公司 | 2017-10-24 | — | — | CN | disclosed |
| EP-2299816-A1 | INHIBITORS OF JANUS KINASES | Merck Sharp & Dohme Corp. (US) | 2011-03-30 | — | — | EP | disclosed |
| WO-2009155156-A1 | INHIBITORS OF JANUS KINASES | MERCK & CO., INC. (US) | 2009-12-23 | — | — | WO | disclosed |