Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACP3 | P15309 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.36 |
| ▸ | PGK1 | P00558 | 1/20 | 0.35 |
| ▸ | PGK2 | P07205 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL15331162 | 0.81 | ACP3 (0.46) | ACP3MEN1KMT2AALDH1A1TSHR | |
| SCHEMBL9729576 | 0.81 | ACP3 (0.46) | ACP3MEN1KMT2AALDH1A1TSHR | |
| SCHEMBL1712223 | 0.78 | ACP3 (0.47) | ACP3MEN1KMT2ATSHRCYP1A2 | |
| SCHEMBL4732102 | 0.78 | ACP3 (0.43) | ACP3MEN1KMT2AALDH1A1AOC3 | |
| SCHEMBL7510418 | 0.78 | ACP3 (0.43) | ACP3MEN1KMT2AALDH1A1AOC3 | |
| SCHEMBL169020 | 0.78 | ACP3 (0.43) | ACP3MEN1KMT2AALDH1A1TSHR | |
| SCHEMBL16399242 | 0.78 | ACP3 (0.43) | ACP3MEN1KMT2AALDH1A1TSHR | |
| SCHEMBL5080717 | 0.78 | HDAC4 (0.44) | MGLLAOC3CYP1A2 | |
| SCHEMBL16794983 | 0.78 | FAAH (0.36) | MGLLTSHRPGK1PGK2 | |
| SCHEMBL1723875 | 0.78 | ESR1 (0.44) | ALDH1A1TSHRADRB1ADRB3PGK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015087094-A1 | NEW ARYLALKENYLPROPARGYLAMINE DERIVATIVES EXHIBITING NEUROPROTECTIVE ACTION FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES | SEMMELWEIS EGYETEM (HU) | 2015-06-18 | — | — | WO | disclosed |
| EP-1792986-B1 | NOVEL CARBONYL REDUCTASE, GENE THEREOF AND METHOD OF USING THE SAME | KANEKA CORP (JP) | 2008-12-31 | — | — | EP | disclosed |
| EP-1907556-A1 | OXIDOREDUCTASES FOR THE STEREOSELECTIVE REDUCTION OF KETO COMPOUNDS | IEP GmbH (DE) | 2008-04-09 | — | — | EP | disclosed |
| WO-2007012428-A1 | OXIDOREDUCTASES FOR THE STEREOSELECTIVE REDUCTION OF KETO COMPOUNDS | IEP GMBH (DE) | 2007-02-01 | — | — | WO | disclosed |
| WO-2006130657-A2 | STEREOSELECTIVE REDUCTION PROCESS FOR THE PREPARATION OF PYRROLOTRIAZINE COMPOUNDS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2006-12-07 | — | — | WO | disclosed |
| WO-1996011006-A1 | 5-HT1F MEDIATED INHIBITION OF NEUROGENIC MENINGEAL EXTRAVASATION | ELI LILLY AND COMPANY (US) | 1996-04-18 | — | — | WO | disclosed |