Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 6/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | APP | P05067 | 2/20 | 0.39 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.39 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | NQO2 | P16083 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8889526 | 0.94 | TDP1 (0.54) | TDP1MAPK1ALDH1A1CYP3A4TSHR | |
| SCHEMBL2881391 | 0.84 | TDP1 (0.52) | TDP1MAPK1ALDH1A1CYP3A4TSHR | |
| SCHEMBL8942092 | 0.82 | TDP1 (0.41) | TDP1MAPK1ALDH1A1CYP3A4TSHR | |
| SCHEMBL1345318 | 0.78 | CA1 (0.55) | TDP1MAPK1ALDH1A1CYP3A4TSHR | |
| SCHEMBL10584935 | 0.77 | CYP3A4 (0.55) | ALDH1A1CYP3A4TSHRAPPMAPT | |
| Hydrochloric Acid SCHEMBL10587060 | 0.76 | CYP3A4 (0.53) | ALDH1A1CYP3A4TSHRAPPMAPT | |
| SCHEMBL15082378 | 0.76 | MEN1 (0.43) | ALDH1A1SMN1; SMN2NPC1HPGDRAB9A | |
| SCHEMBL5563 | 0.75 | PARP10 (0.54) | TDP1MAPK1ALDH1A1CYP3A4TSHR | |
| SCHEMBL38655995 | 0.75 | TDP1 (0.52) | TDP1MAPK1ALDH1A1CYP3A4TSHR | |
| 4,4'-Methylenedianiline SCHEMBL15663308 | 0.73 | TDP1 (0.56) | TDP1MAPK1ALDH1A1CYP3A4TSHR |
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-4143228-A | RED SHADES | BAYER AKTIENGESELLSCHAFT (DE) | 1979-03-06 | — | — | US | disclosed |