Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 4/20 | 0.45 |
| ▸ | CRHBP | P24387 | 2/20 | 0.44 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.44 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.44 |
| ▸ | SLC25A1 | P53007 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | NFKBIA | P25963 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | GUSB | P08236 | 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 | |
|---|---|---|---|---|
| SCHEMBL9750345 | 0.83 | GAA (0.54) | VCAM1PKMDNMT1DNMT3AGAA | |
| SCHEMBL10615498 | 0.79 | CRHBP (0.67) | VCAM1CRHBPCRHR2PKMDNMT1 | |
| SCHEMBL10715096 | 0.71 | PGR (0.53) | VCAM1PKMSLC25A1CA12GAA | |
| SCHEMBL10657289 | 0.71 | ALDH1A1 (0.71) | VCAM1CRHBPCRHR2PKMDNMT1 | |
| SCHEMBL28711028 | 0.70 | ALDH1A1 (0.70) | VCAM1CRHBPCRHR2PKMDNMT1 | |
| SCHEMBL10714480 | 0.70 | PGK1 (0.59) | VCAM1ALDH1A1GAALMNAMAPT | |
| SCHEMBL17047621 | 0.69 | MEN1 (0.54) | CRHBPCRHR2PKMGAASMN1; SMN2 | |
| SCHEMBL13583564 | 0.69 | MAPT (0.52) | CRHBPCRHR2ALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL7786706 | 0.69 | ALDH1A1 (0.50) | VCAM1ALDH1A1HTTMAPK1 | |
| SCHEMBL5956066 | 0.69 | LMNA (0.57) | VCAM1CRHBPCRHR2PKMDNMT1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4666453-A | Nitro-meta-phenylenediamines halogenated in the 6th position and their use in dyeing keratinic substances | L'OREAL (FR) | 1987-05-19 | — | — | US | disclosed |