Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 5/20 | 0.40 |
| ▸ | HPGD | P15428 | 5/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | GLP1R | P43220 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 2/20 | 0.35 |
| ▸ | APAF1 | O14727 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8756175 | 0.77 | ALDH1A1 (0.54) | ALDH1A1KDM4EKMT2ANPSR1HPGD | |
| SCHEMBL9639513 | 0.73 | TSHR (0.44) | ALDH1A1KDM4EKMT2ANPSR1HPGD | |
| SCHEMBL15571327 | 0.71 | ALDH1A1 (0.59) | ALDH1A1KDM4EKMT2ANPSR1HPGD | |
| SCHEMBL27847094 | 0.71 | MAPK8 (0.39) | ALDH1A1KDM4EKMT2ANPSR1HPGD | |
| SCHEMBL7013616 | 0.69 | KDM4E (0.56) | ALDH1A1KDM4EKMT2ANPSR1HPGD | |
| SCHEMBL11003306 | 0.69 | GLP1R (0.40) | ALDH1A1KDM4EKMT2ANPSR1HPGD | |
| SCHEMBL10955979 | 0.69 | GLP1R (0.41) | ALDH1A1KDM4EHTTGLP1RMAPT | |
| SCHEMBL2569634 | 0.68 | KDM4E (0.47) | ALDH1A1KDM4EKMT2ANPSR1HPGD | |
| SCHEMBL11882984 | 0.68 | KMT2A (0.39) | ALDH1A1KDM4EKMT2ANPSR1HPGD | |
| SCHEMBL13828376 | 0.68 | ALDH1A1 (0.46) | ALDH1A1KDM4EKMT2ANPSR1HPGD |
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-0244360-B1 | SUBSTITUTED PYRIMIDINES | CIBA-GEIGY AG (CH) | 1992-08-19 | — | — | EP | disclosed |
| US-4783468-A | Insecticidal 5-pyrimidine carbonitriles | CIBA-GEIGY CORPORATION (US) | 1988-11-08 | — | — | US | disclosed |
| CN-87103168-A | The pyrimidines that replaces | — | 1987-12-16 | — | — | CN | disclosed |
| EP-0244360-A2 | Substituted pyrimidines | CIBA-GEIGY AG (CH) | 1987-11-04 | — | — | EP | disclosed |