Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.37 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL1143624 | 0.92 | ESR1 (0.54) | KMT2AALDH1A1ESR1ESR2MT-CO2 | |
| SCHEMBL2585312 | 0.92 | ESR1 (0.54) | KMT2AALDH1A1ESR1ESR2MT-CO2 | |
| SCHEMBL14032514 | 0.92 | L3MBTL1 (0.46) | KMT2AALDH1A1MT-CO2CA12CA1 | |
| SCHEMBL8252300 | 0.92 | L3MBTL1 (0.45) | KMT2AALDH1A1ESR1ESR2MT-CO2 | |
| SCHEMBL8058922 | 0.92 | L3MBTL1 (0.45) | KMT2AALDH1A1ESR1ESR2MT-CO2 | |
| SCHEMBL1143625 | 0.92 | ESR1 (0.54) | KMT2AALDH1A1ESR1ESR2MT-CO2 | |
| SCHEMBL9620180 | 0.92 | SLC6A3 (0.47) | KMT2AALDH1A1ESR1ESR2MT-CO2 | |
| SCHEMBL3504026 | 0.90 | CYP1A2 (0.48) | KMT2AALDH1A1SMN1; SMN2CYP1A2MAPK1 | |
| SCHEMBL2426957 | 0.90 | RAB9A (0.49) | KMT2ACA1CA2SMN1; SMN2CYP1A2 | |
| SCHEMBL1969493 | 0.90 | RAB9A (0.49) | KMT2ACA1CA2SMN1; SMN2CYP1A2 |
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-9000219-B2 | Method for treatment of isocyanate residue, and method for treatment of carbonate | MITSUI CHEMICALS, INC. (JP) | 2015-04-07 | — | — | US | disclosed |
| US-20120271067-A1 | METHOD FOR TREATMENT OF ISOCYANATE RESIDUE, AND METHOD FOR TREATMENT OF CARBONATE | MITSUI CHEMICALS, INC. | 2012-10-25 | — | — | US | disclosed |
| US-6639101-B2 | Catalytic thermal decomposition of carbamates using silicates (clays, zeolites) as catalysts | REPSOL QUIMICA, S.A. (ES) | 2003-10-28 | — | — | US | disclosed |