Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 5/20 | 0.45 |
| ▸ | CYP2E1 | P05181 | 3/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.45 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL17590203 | 0.85 | KDM4E (0.50) | KDM4ESMN1; SMN2CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL11390738 | 0.83 | KDM4E (0.51) | KDM4ESMN1; SMN2CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL290740 | 0.80 | CYP3A4 (0.62) | KDM4ESMN1; SMN2CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL11402495 | 0.79 | NPC1 (0.46) | KDM4ESMN1; SMN2CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL290103 | 0.79 | KDM4E (0.50) | KDM4ESMN1; SMN2CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL17589712 | 0.78 | KDM4E (0.44) | KDM4ESMN1; SMN2CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL5734672 | 0.77 | CYP1A2 (0.56) | KDM4ESMN1; SMN2CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL16601902 | 0.76 | KDM4E (0.54) | KDM4ESMN1; SMN2CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL11629769 | 0.76 | CYP2A6 (0.48) | KDM4ECYP3A4CYP2C19CYP1A2LMNA | |
| Hydrochloric Acid SCHEMBL31734146 | 0.75 | KDM4E (0.53) | KDM4ESMN1; SMN2CYP3A4CYP2C19CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104507935-B | Process for preparing certain 2- (pyridin-3-yl) thiazoles | 美国陶氏益农公司 | 2016-10-19 | — | — | CN | disclosed |