Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 13/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | PRMT1 | Q99873 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | TOP1 | P11387 | 1/20 | 0.51 |
| ▸ | CASP1 | P29466 | 1/20 | 0.51 |
| ▸ | CASP7 | P55210 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | PKM | P14618 | 2/20 | 0.51 |
| ▸ | TOP2A | P11388 | 1/20 | 0.50 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.50 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.46 |
| ▸ | TMPRSS15 | P98073 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9250170 | 0.86 | NQO2 (0.61) | NQO2ALDH1A1PRMT1HPGDTOP1 | |
| SCHEMBL9254121 | 0.84 | ALDH1A1 (0.64) | NQO2ALDH1A1PRMT1HPGDTOP1 | |
| SCHEMBL9248638 | 0.80 | RXRA (0.53) | NQO2ALDH1A1PRMT1HPGDTOP1 | |
| Hydrochloric Acid SCHEMBL9254695 | 0.77 | NQO2 (0.39) | NQO2ALDH1A1HPGDKDM4EMAPT | |
| SCHEMBL9250754 | 0.76 | KMT2A (0.49) | ALDH1A1TDP1KDM4EMAPTPKM | |
| SCHEMBL9250757 | 0.75 | NQO2 (0.51) | NQO2HPGDPRSS1TMPRSS15 | |
| SCHEMBL17537987 | 0.74 | ALDH1A1 (0.48) | ALDH1A1HPGDHSD17B10KDM4EMAPT | |
| SCHEMBL9258660 | 0.74 | F2 (0.44) | NQO2ALDH1A1HPGDHSD17B10KDM4E | |
| Hydrochloric Acid SCHEMBL9254391 | 0.74 | ST14 (0.54) | PRSS1 | |
| SCHEMBL9254531 | 0.73 | TMPRSS15 (0.43) | NQO2HPGDMAPTSMN1; SMN2PRSS1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5463071-A | Tetrazole derivatives; useful for inhibiting undesirable cell aggregation | DR. KARL THOMAE GMBH (DE) | 1995-10-31 | — | — | US | disclosed |
| EP-0525629-A2 | 5-membered heterocycles, process for their preparation and medicaments containing them | Dr. Karl Thomae GmbH (DE) | 1993-02-03 | — | — | EP | disclosed |