Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 14/20 | 1.00 |
| ▸ | SRC | P12931 | 10/20 | 1.00 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.61 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8999075 | 0.89 | EGFR (0.80) | EGFRSRCMEN1KMT2ARXFP1 | |
| SCHEMBL8999391 | 0.79 | EGFR (1.00) | EGFRSRCMEN1KMT2A | |
| SCHEMBL13598032 | 0.76 | KMT2A (1.00) | EGFRSRCMEN1KMT2ARXFP1 | |
| SCHEMBL8999187 | 0.74 | EGFR (1.00) | EGFRSRC | |
| SCHEMBL6353285 | 0.71 | GAA (0.72) | EGFRSRCMEN1KMT2ARXFP1 | |
| SCHEMBL27681874 | 0.71 | HDAC6 (0.60) | EGFRSRCMEN1KMT2ARXFP1 | |
| SCHEMBL11640078 | 0.69 | TSHR (0.60) | EGFRSRCMEN1KMT2AKDM4E | |
| SCHEMBL8999074 | 0.69 | EGFR (0.80) | EGFRSRCKMT2AKDM4ETSHR | |
| SCHEMBL8251765 | 0.69 | GABRP (0.74) | MEN1KMT2AKDM4E | |
| SCHEMBL8998976 | 0.69 | EGFR (0.79) | EGFRSRCMEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5556874-A | ENZYME INHIBITORS AS ANTICARCINOGENIC AGENTS | WARNER LAMBERT COMPANY (US) | 1996-09-17 | — | — | US | disclosed |
| EP-0654024-A1 | 2-THIOINDOLES (SELENOINDOLES) AND RELATED DISULFIDES (SELENIDES) WHICH INHIBIT PROTEIN TYROSINE KINASES AND WHICH HAVE ANTITUMOR PROPERTIES | WARNER-LAMBERT COMPANY (US) | 1995-05-24 | — | — | EP | disclosed |
| WO-1994003427-A1 | 2-THIOINDOLES (SELENOINDOLES) AND RELATED DISULFIDES (SELENIDES) WHICH INHIBIT PROTEIN TYROSINE KINASES AND WHICH HAVE ANTITUMOR PROPERTIES | WARNER-LAMBERT COMPANY (US) | 1994-02-17 | — | — | WO | disclosed |