Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA5A | P35218 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8797902 | 0.79 | ALDH1A1 (0.43) | ALDH1A1KMT2ATDP1MAPTTSHR | |
| SCHEMBL8798720 | 0.78 | ALDH1A1 (0.46) | ALDH1A1MEN1KMT2ACYP3A4MAPT | |
| SCHEMBL77335 | 0.76 | POLB (0.46) | ALDH1A1MEN1KMT2AUSP2KEAP1 | |
| SCHEMBL8799644 | 0.75 | GLA (0.38) | ALDH1A1MEN1KMT2AMAPTPOLB | |
| SCHEMBL8797956 | 0.74 | ADRB2 (0.32) | ALDH1A1 | |
| SCHEMBL27832802 | 0.73 | MEN1 (0.53) | ALDH1A1MEN1KMT2AUSP2KEAP1 | |
| SCHEMBL1933923 | 0.73 | TSHR (0.47) | ALDH1A1MEN1KMT2AUSP2KEAP1 | |
| SCHEMBL19952852 | 0.71 | IMPDH2 (0.41) | ALDH1A1MEN1KMT2AUSP2KEAP1 | |
| SCHEMBL14638102 | 0.71 | HTT (0.44) | ALDH1A1MEN1KMT2AUSP2KEAP1 | |
| SCHEMBL4365843 | 0.70 | POLB (0.48) | ALDH1A1MEN1KMT2AUSP2KEAP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0532039-B1 | N1-trifluoroalkyl substituted 2-nitro-p-phenylenediamine dyes | BRISTOL MYERS SQUIBB CO (US) | 1997-12-03 | — | — | EP | claimed |
| EP-0532039-A1 | N1-trifluoroalkyl substituted 2-nitro-p-phenylenediamine dyes | Bristol-Myers Squibb Company (US) | 1993-03-17 | — | — | EP | claimed |
| EP-0532039-B1 | N1-trifluoroalkyl substituted 2-nitro-p-phenylenediamine dyes | BRISTOL MYERS SQUIBB CO (US) | 1997-12-03 | — | — | EP | disclosed |
| EP-0532039-A1 | N1-trifluoroalkyl substituted 2-nitro-p-phenylenediamine dyes | Bristol-Myers Squibb Company (US) | 1993-03-17 | — | — | EP | disclosed |