Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.32 |
| ▸ | HPGD | P15428 | 5/20 | 0.32 |
| ▸ | POLB | P06746 | 4/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 2/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10583190 | 1.00 | ALDH1A1 (0.32) | ALDH1A1HPGDPOLBMAPK1TP53 | |
| SCHEMBL8562171 | 0.90 | ALDH1A1 (0.32) | ALDH1A1HPGDPOLBMAPK1TP53 | |
| SCHEMBL8562173 | 0.90 | ALDH1A1 (0.32) | ALDH1A1HPGDPOLBMAPK1TP53 | |
| SCHEMBL9770983 | 0.88 | POLB (0.31) | ALDH1A1HPGDPOLBMAPK1TP53 | |
| SCHEMBL9770845 | 0.82 | POLB (0.32) | ALDH1A1HPGDPOLBMAPK1TP53 | |
| Fluthiacetmethyl SCHEMBL29405302 | 0.78 | KMT2A (0.35) | ALDH1A1HPGDPOLBTP53TSHR | |
| Fluthiacetmethyl SCHEMBL9048322 | 0.78 | KMT2A (0.35) | ALDH1A1HPGDPOLBTP53TSHR | |
| Fluthiacetmethyl SCHEMBL39080 | 0.78 | KMT2A (0.35) | ALDH1A1HPGDPOLBTP53TSHR | |
| Fluthiacetmethyl SCHEMBL8437784 | 0.78 | KMT2A (0.35) | ALDH1A1HPGDPOLBTP53TSHR | |
| Fluthiacetmethyl SCHEMBL20723677 | 0.77 | KMT2A (0.35) | ALDH1A1HPGDPOLBTP53TSHR |
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 |
|---|---|---|---|---|---|---|---|
| JP-1186894-A | — | — | None | — | — | JP | disclosed |
| JP-H01186894-A | CONDENSED HETEROCYCLIC DERIVATIVE AND HERBICIDE | NISSAN CHEM IND LTD | 1989-07-26 | — | — | JP | disclosed |