Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 20/20 | 0.58 |
| ▸ | INSR | P06213 | 1/20 | 0.51 |
| ▸ | IGF1R | P08069 | 1/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL17196684 | 0.88 | EGFR (0.66) | EGFRINSRIGF1RKCNH2 | |
| Formic Acid SCHEMBL18549295 | 0.86 | EGFR (0.64) | EGFRINSRIGF1RKCNH2 | |
| SCHEMBL18549237 | 0.84 | EGFR (0.66) | EGFRINSRIGF1RKCNH2 | |
| SCHEMBL17196834 | 0.84 | EGFR (0.66) | EGFRINSRIGF1RKCNH2 | |
| SCHEMBL17196821 | 0.84 | EGFR (0.66) | EGFRINSRIGF1RKCNH2 | |
| SCHEMBL17196844 | 0.83 | EGFR (0.60) | EGFR | |
| SCHEMBL17196889 | 0.83 | EGFR (0.67) | EGFRINSRIGF1RKCNH2 | |
| SCHEMBL17196852 | 0.83 | EGFR (0.67) | EGFRINSRIGF1RKCNH2 | |
| SCHEMBL18563150 | 0.83 | EGFR (0.67) | EGFRINSRIGF1RKCNH2 | |
| SCHEMBL17196693 | 0.83 | EGFR (0.63) | EGFRINSRIGF1RKCNH2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3144292-A1 | 2,3,4,6-TETRA-SUBSTITUTED BENZENE-1,5-DIAMINE DERIVATIVES, PREPARATION METHOD THEREFOR AND MEDICINAL USE THEREOF | SHANGHAI HAIYAN PHARMACEUTICAL TECHNOLOGY CO., LTD (US) | 2017-03-22 | — | — | EP | disclosed |
| WO-2015158233-A1 | 2,3,4,6-TETRA-SUBSTITUTED BENZENE-1,5-DIAMINE DERIVATIVES, PREPARATION METHOD THEREFOR AND MEDICINAL USE THEREOF | 上海海雁医药科技有限公司 | 2015-10-22 | — | — | WO | disclosed |