Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | DHFR | P00374 | 1/20 | 0.45 |
| ▸ | NQO1 | P15559 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11317842 | 0.77 | DHFR (0.45) | ALDH1A1KDM4ESMN1; SMN2DHFRNQO1 | |
| SCHEMBL11342978 | 0.77 | KDM4E (0.46) | ALDH1A1KDM4ESMN1; SMN2DHFRNQO1 | |
| SCHEMBL10998181 | 0.76 | NQO1 (0.46) | KDM4EDHFRNQO1MAPTESR2 | |
| SCHEMBL11317835 | 0.73 | NQO1 (0.39) | ALDH1A1KDM4ESMN1; SMN2DHFRNQO1 | |
| SCHEMBL11314251 | 0.72 | DHFR (0.41) | ALDH1A1KDM4ESMN1; SMN2DHFRNQO1 | |
| SCHEMBL11310224 | 0.72 | DHFR (0.43) | ALDH1A1KDM4ESMN1; SMN2DHFRNQO1 | |
| SCHEMBL2498271 | 0.70 | NQO1 (0.59) | ALDH1A1KDM4ENQO1MAPTESR2 | |
| SCHEMBL29657372 | 0.70 | NQO1 (0.59) | ALDH1A1KDM4ENQO1MAPTESR2 | |
| SCHEMBL11596353 | 0.68 | KDM4E (0.50) | ALDH1A1KDM4ESMN1; SMN2MAPTTSHR | |
| SCHEMBL9488121 | 0.67 | NQO1 (0.54) | ALDH1A1KDM4ESMN1; SMN2NQO1MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4268439-A | Basic azo dyestuffs having benzylammoniumamine substituent in the coupling component | BAYER AKTIENGESELLSCHAFT (DE) | 1981-05-19 | — | — | US | disclosed |
| US-4233214-A | FOR POLYACRYLONITRILE AND ACID-MODIFIED POLYESTERS OR POLYAMIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1980-11-11 | — | — | US | disclosed |
| US-4036826-A | Cationic azo dyestuffs with a hydroxyalkylated ammonium group | BAYER AKTIENGESELLSCHAFT (DT) | 1977-07-19 | — | — | US | disclosed |