Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 12/20 | 0.53 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.51 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.48 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | PIP4K2A | P48426 | 1/20 | 0.46 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7535181 | 0.99 | EGFR (0.52) | EGFRGRM1ERBB2HDAC1HDAC6 | |
| SCHEMBL7661721 | 0.85 | GRM1 (0.56) | EGFRGRM1ERBB2MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL7536080 | 0.84 | GRM1 (0.55) | EGFRGRM1ERBB2MEN1KMT2A | |
| SCHEMBL7543155 | 0.82 | GRM1 (0.74) | EGFRGRM1ERBB2MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL7537987 | 0.81 | GRM1 (0.72) | EGFRGRM1ERBB2MEN1KMT2A | |
| SCHEMBL7534837 | 0.80 | EGFR (0.67) | EGFRGRM1ERBB2HDAC1HDAC6 | |
| SCHEMBL11902821 | 0.78 | EGFR (0.70) | EGFRGRM1ERBB2MEN1KMT2A | |
| SCHEMBL868343 | 0.77 | EGFR (0.69) | EGFRGRM1ERBB2MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL7541622 | 0.76 | LMNA (0.52) | EGFRLMNAMAPTHTTSMN1; SMN2 | |
| SCHEMBL16994115 | 0.75 | EGFR (0.64) | EGFRERBB2ERBB4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1141298-A | Pyrimidine-fused heterocyclic compound anti-cancer agents | PFIZER (US) | 1997-01-29 | — | — | CN | claimed |
| CN-1141298-A | Pyrimidine-fused heterocyclic compound anti-cancer agents | PFIZER (US) | 1997-01-29 | — | — | CN | disclosed |