Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.59 |
| ▸ | HTR2A | P28223 | 2/20 | 0.54 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.54 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.54 |
| ▸ | IDO1 | P14902 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL19472539 | 0.94 | MAOA (0.63) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| SCHEMBL1579959 | 0.92 | MAOA (0.61) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| SCHEMBL3438742 | 0.92 | MAOA (0.65) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| Phenethylamine SCHEMBL7263898 | 0.92 | HTR2A (0.67) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| SCHEMBL22268839 | 0.88 | MAOA (0.67) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| SCHEMBL22873145 | 0.88 | HTR2A (0.50) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| SCHEMBL4726492 | 0.87 | HTR2A (0.58) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| SCHEMBL10818930 | 0.86 | MAOA (0.69) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| SCHEMBL4030630 | 0.85 | MAOB (0.57) | MAOASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL29004380 | 0.85 | HTR2A (0.56) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1184364-B1 | COMB-SHAPED DIOL, WATER-SOLUBLE POLYURETHANE, AND USE THEREOF | MITSUI CHEMICALS INC (JP) | 2010-07-28 | — | — | EP | disclosed |
| US-6515050-B1 | An extruding auxiliary using the above novel water-soluble polyurethane; additive for underwater concrete | MITSUI CHEMICALS, INC. (JP) | 2003-02-04 | — | — | US | disclosed |
| EP-1184364-A1 | COMB-SHAPED DIOL, WATER-SOLUBLE POLYURETHANE, AND USE THEREOF | Mitsui Chemicals, Inc. (JP) | 2002-03-06 | — | — | EP | disclosed |
| US-4157893-A | MONO OR DISAZO DYE CONTAINING AN AMINO-SUBSTITUTED PYRIMIDINE RING | BASF AKTIENGESELLSCHAFT (DE) | 1979-06-12 | — | — | US | disclosed |
| US-4150943-A | Uniformly dyed water-swellable cellulosic fibers | BASF AKTIENGESELLSCHAFT (DE) | 1979-04-24 | — | — | US | disclosed |
| US-4146535-A | Azo dyes having a 3-cyano- or 3-carbamoyl-2,6-diamino-pyridine coupling component | BASF AKTIENGESELLSCHAFT (DE) | 1979-03-27 | — | — | US | disclosed |