Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.32 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CDC7 | O00311 | 1/20 | 0.31 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.31 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.31 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.31 |
| ▸ | PAK4 | O96013 | 1/20 | 0.31 |
| ▸ | PIM1 | P11309 | 1/20 | 0.31 |
| ▸ | PRKACA | P17612 | 1/20 | 0.31 |
| ▸ | FLT3 | P36888 | 1/20 | 0.31 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.31 |
| ▸ | CLK2 | P49760 | 1/20 | 0.31 |
| ▸ | GSK3B | P49841 | 1/20 | 0.31 |
| ▸ | CDK7 | P50613 | 1/20 | 0.31 |
| ▸ | CDK9 | P50750 | 1/20 | 0.31 |
| ▸ | PRKX | P51817 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9720940 | 0.83 | TSHR (0.40) | TSHRCYP3A4 | |
| SCHEMBL2087532 | 0.80 | NOS3 (0.45) | CDK2TSHRCYP3A4MAPTKDM4E | |
| SCHEMBL29560454 | 0.80 | NOS3 (0.45) | CDK2TSHRCYP3A4MAPTKDM4E | |
| SCHEMBL24126364 | 0.80 | KDM4E (0.42) | CDK2HSP90AA1MAPTKDM4EKMT2A | |
| SCHEMBL13907103 | 0.77 | RIPK2 (0.36) | CDK2KDM4EKMT2A | |
| SCHEMBL11183774 | 0.74 | TSHR (0.46) | TSHRCYP3A4 | |
| SCHEMBL10652897 | 0.73 | TSHR (0.33) | TSHRCYP3A4 | |
| SCHEMBL18197814 | 0.72 | KMT2A (0.35) | CDK2KDM4EKMT2A | |
| SCHEMBL10379189 | 0.72 | ALDH1A1 (0.36) | TSHRMAPTKMT2A | |
| SCHEMBL13884662 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4266964-A | SAID ANTIDOTES BEING CHLOROPYRIDINE COMPOUNDS | THE DOW CHEMICAL COMPANY (US) | 1981-05-12 | — | — | US | disclosed |