Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYMS | P04818 | 5/20 | 0.53 |
| ▸ | CRHBP | P24387 | 1/20 | 0.45 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | CASP1 | P29466 | 2/20 | 0.40 |
| ▸ | CASP7 | P55210 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 2/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.38 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7130501 | 0.77 | TYMS (0.74) | TYMSCRHBPCRHR2KDM4EALDH1A1 | |
| SCHEMBL22590221 | 0.72 | TYMS (0.51) | TYMSCRHBPCRHR2KDM4EALDH1A1 | |
| SCHEMBL18906930 | 0.70 | PDK2 (0.40) | KDM4EALDH1A1 | |
| SCHEMBL15847664 | 0.69 | TYMS (0.52) | TYMSCRHBPCRHR2KDM4EALDH1A1 | |
| SCHEMBL10440496 | 0.69 | TYMS (0.52) | TYMSCRHBPCRHR2KDM4EALDH1A1 | |
| SCHEMBL7119781 | 0.69 | TYMS (0.52) | TYMSCRHBPCRHR2KDM4EALDH1A1 | |
| SCHEMBL7118969 | 0.67 | TYMS (0.49) | TYMSCRHBPCRHR2KDM4EALDH1A1 | |
| SCHEMBL5439179 | 0.66 | DHFR (0.48) | TYMSCRHBPCRHR2ALDH1A1KMT2A | |
| SCHEMBL17369769 | 0.66 | CRHBP (0.51) | TYMSCRHBPCRHR2ALDH1A1CASP1 | |
| SCHEMBL26327483 | 0.66 | TYMS (0.47) | TYMSCRHBPCRHR2KDM4EALDH1A1 |
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-9920024-B2 | Method for purifying compound or resin | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2018-03-20 | — | — | US | disclosed |