Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | AHR | P35869 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | CA9 | Q16790 | 3/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | RAD52 | P43351 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2697123 | 0.94 | CYP1A2 (0.58) | CYP1A2CYP2C19KMT2ALMNAMEN1 | |
| SCHEMBL11808006 | 0.92 | LMNA (0.46) | CYP1A2CYP2C19KMT2ALMNAMEN1 | |
| SCHEMBL17576127 | 0.91 | CYP1A2 (0.42) | CYP1A2CYP2C19KMT2ALMNAMEN1 | |
| SCHEMBL7764235 | 0.88 | KMT2A (0.66) | CYP1A2CYP2C19KMT2ALMNAMEN1 | |
| SCHEMBL17576131 | 0.87 | KMT2A (0.56) | CYP1A2CYP2C19KMT2ALMNAMEN1 | |
| SCHEMBL8077062 | 0.84 | KMT2A (0.54) | CYP1A2CYP2C19KMT2AHTTCYP3A4 | |
| SCHEMBL10543159 | 0.83 | CYP1A2 (0.61) | CYP1A2CYP2C19KMT2ALMNAMEN1 | |
| SCHEMBL9490786 | 0.83 | CYP1A2 (0.46) | CYP1A2CYP2C19KMT2ALMNACA1 | |
| SCHEMBL10899963 | 0.82 | KMT2A (0.43) | CYP1A2CYP2C19KMT2ALMNAMEN1 | |
| Simetryn SCHEMBL8409672 | 0.82 | LMNA (0.54) | CYP1A2CYP2C19KMT2ALMNAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2359692-A1 | Herbicidal compositions | ISAGRO S.p.A. (IT) | 2011-08-24 | — | — | EP | disclosed |
| US-3988292-A | A TRIAZINE DERIVATIVE | TEIJIN LIMITED (JA) | 1976-10-26 | — | — | US | disclosed |