Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 3/20 | 0.41 |
| ▸ | CA9 | Q16790 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.40 |
| ▸ | SCN1A | P35498 | 2/20 | 0.40 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.40 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.37 |
| ▸ | TP53 | P04637 | 4/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.37 |
| ▸ | THPO | P40225 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21990559 | 0.74 | CA12 (0.48) | RECQLCA12CA9ALDH1A1KDM4E | |
| SCHEMBL7525621 | 0.73 | CYP1A2 (0.44) | CA12CA9ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL10870064 | 0.73 | ALDH1A1 (0.38) | CA12CA9ALDH1A1CYP2C9TSHR | |
| SCHEMBL4069684 | 0.73 | ALDH1A1 (0.75) | ALDH1A1KDM4ELMNAPKMSMN1; SMN2 | |
| SCHEMBL17486855 | 0.73 | BCHE (0.51) | RECQLCA12CA9ALDH1A1KDM4E | |
| SCHEMBL17489495 | 0.73 | ALDH1A1 (0.42) | ALDH1A1KDM4ELMNASMN1; SMN2CYP1A2 | |
| SCHEMBL17486852 | 0.72 | HRAS (0.56) | ALDH1A1KDM4ESMN1; SMN2MAPK1TDP1 | |
| SCHEMBL17486854 | 0.71 | HTR1B (0.49) | ALDH1A1KDM4ECYP1A2CYP3A4CYP2C19 | |
| SCHEMBL10900779 | 0.70 | RECQL (0.65) | RECQLCA12CA9ALDH1A1KDM4E | |
| SCHEMBL1396538 | 0.69 | ALDH1A1 (0.44) | CA12CA9ALDH1A1LMNACYP2C9 |
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-1092639-C | Benzene-fused heterocyclic derivative and use thereof | TORAY INDUSTRIES (JP) | 2002-10-16 | — | — | CN | disclosed |
| CN-1148381-A | Benzene-fused heterocyclic derivative and use thereof | TORAY INDUSTRIES (JP) | 1997-04-23 | — | — | CN | disclosed |