Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 7/20 | 0.52 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.52 |
| ▸ | TUBB | P07437 | 1/20 | 0.52 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.52 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.52 |
| ▸ | KDR | P35968 | 1/20 | 0.52 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.52 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.52 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.52 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.52 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.52 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.52 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.52 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.52 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.52 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.52 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.52 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.52 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.48 |
| ▸ | CSF1R | P07333 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8645741 | 0.84 | EGFR (0.69) | EGFRTUBB4ATUBBPDGFRBTUBA3C | |
| SCHEMBL8081991 | 0.83 | EGFR (0.66) | EGFRTUBB4ATUBBPDGFRBTUBA3C | |
| Hydrochloric Acid SCHEMBL8648577 | 0.76 | EGFR (0.70) | EGFRPDGFRBKDRCSF1RKIT | |
| SCHEMBL8081981 | 0.73 | EGFR (0.55) | EGFRTUBB4ATUBBPDGFRBTUBA3C | |
| SCHEMBL28499625 | 0.72 | HRH3 (0.70) | SRD5A1HRH3CYP2D6HRH1MAOB | |
| SCHEMBL11043671 | 0.71 | SRD5A1 (0.54) | SRD5A1HRH3CYP2D6HRH1MAOB | |
| SCHEMBL8090078 | 0.71 | EGFR (0.48) | EGFRTUBB4ATUBBPDGFRBTUBA3C | |
| SCHEMBL7124185 | 0.71 | EGFR (0.63) | EGFRTUBB4ATUBBPDGFRBTUBA3C | |
| SCHEMBL17050489 | 0.70 | SRD5A1 (0.53) | SRD5A1HRH3CYP2D6HRH1MAOB | |
| Hydrochloric Acid SCHEMBL8649920 | 0.70 | EGFR (0.76) | EGFRTUBB4ATUBBPDGFRBTUBA3C |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6153617-A | Irreversible bicyclic inhibitors of tyrosine kinases | WARNER-LAMBERT COMPANY (US) | 2000-11-28 | — | — | US | claimed |
| WO-1999006396-A1 | IRREVERSIBLE BICYCLIC INHIBITORS OF TYROSINE KINASES | WARNER-LAMBERT COMPANY (US) | 1999-02-11 | — | — | WO | claimed |
| US-6153617-A | Irreversible bicyclic inhibitors of tyrosine kinases | WARNER-LAMBERT COMPANY (US) | 2000-11-28 | — | — | US | disclosed |
| WO-1999006396-A1 | IRREVERSIBLE BICYCLIC INHIBITORS OF TYROSINE KINASES | WARNER-LAMBERT COMPANY (US) | 1999-02-11 | — | — | WO | disclosed |