Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | EGFR | P00533 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | CYP1B1 | Q16678 | 6/20 | 0.43 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.43 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.42 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.42 |
| ▸ | CYP1A1 | P04798 | 4/20 | 0.41 |
| ▸ | LDHA | P00338 | 1/20 | 0.41 |
| ▸ | ERN1 | O75460 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9730667 | 0.78 | ERN1 (0.46) | KDM4EEGFRALDH1A1POLBGAA | |
| SCHEMBL9731164 | 0.77 | ERN1 (0.62) | KDM4EEGFRALDH1A1POLBGAA | |
| SCHEMBL9731169 | 0.77 | ERN1 (0.62) | KDM4EEGFRALDH1A1POLBGAA | |
| SCHEMBL9731127 | 0.77 | EGFR (0.53) | KDM4EEGFRALDH1A1POLBGAA | |
| SCHEMBL589343 | 0.77 | ERN1 (0.55) | ALDH1A1MAPTCYP1B1PTPN22CYP1A1 | |
| SCHEMBL9732410 | 0.77 | EGFR (0.56) | KDM4EEGFRALDH1A1POLBGAA | |
| SCHEMBL9732522 | 0.76 | EGFR (0.55) | KDM4EEGFRALDH1A1POLBGAA | |
| SCHEMBL8423542 | 0.76 | CYP1B1 (0.55) | KDM4EPKMCYP1B1ABCG2PTPN22 | |
| SCHEMBL8423545 | 0.76 | CYP1B1 (0.55) | KDM4EPKMCYP1B1ABCG2PTPN22 | |
| SCHEMBL9731055 | 0.75 | EGFR (0.45) | KDM4EEGFRALDH1A1POLBGAA |
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-5122537-A | Tyrosine kinase inhibitors | FARMITALIA CARLO ERBA S.R.L. (IT) | 1992-06-16 | — | — | US | claimed |
| JP-4210946-A | — | — | None | — | — | JP | disclosed |
| JP-H04210946-A | NEW ARYLVINYLAMIDE DERIVATIVE AND ITS PREPARATION | FARMITALIA CARLO ERBA SPA | 1992-08-03 | — | — | JP | disclosed |
| US-5122537-A | Tyrosine kinase inhibitors | FARMITALIA CARLO ERBA S.R.L. (IT) | 1992-06-16 | — | — | US | disclosed |