Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA5A | P35218 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15856849 | 0.82 | NTRK1 (0.37) | LMNANTRK1CA12CA1CA2 | |
| SCHEMBL16078095 | 0.82 | L3MBTL1 (0.44) | NTRK1CYP1A2GAACYP2C19MEN1 | |
| SCHEMBL16592911 | 0.82 | GLA (0.34) | LMNACYP1A2CYP2C19GLAMEN1 | |
| SCHEMBL20540627 | 0.81 | NTRK1 (0.39) | LMNANTRK1CA12CA1CA2 | |
| Hydrochloric Acid SCHEMBL5497815 | 0.81 | NTRK1 (0.37) | LMNANTRK1CA12CA1CA2 | |
| SCHEMBL28407540 | 0.79 | IDO1 (0.36) | LMNANTRK1CYP1A2CYP3A4GAA | |
| SCHEMBL28755600 | 0.77 | NTRK1 (0.39) | LMNANTRK1CYP1A2CYP3A4GAA | |
| SCHEMBL5497817 | 0.76 | CCNC (0.46) | CYP3A4GAACA12CA1CA2 | |
| SCHEMBL5500005 | 0.75 | NTRK1 (0.35) | LMNANTRK1CA12CA1CA2 | |
| SCHEMBL6427812 | 0.75 | NTRK1 (0.35) | LMNANTRK1TSHRCA12CA1 |
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-107787324-B | Process for preparing carbamoylaminopyrazole derivatives | 桑多斯股份公司 | 2020-05-19 | — | — | CN | disclosed |