Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 2/20 | 0.62 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.56 |
| ▸ | IDO1 | P14902 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | CYP2A13 | Q16696 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | DBH | P09172 | 1/20 | 0.41 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 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 | |
|---|---|---|---|---|
| SCHEMBL29118641 | 0.87 | PNMT (0.44) | PNMTTAAR1IDO1KDM4EALDH1A1 | |
| SCHEMBL2290388 | 0.79 | — | — | |
| SCHEMBL3302008 | 0.79 | PNMT (0.68) | PNMTTAAR1IDO1KDM4EALDH1A1 | |
| SCHEMBL283449 | 0.77 | PNMT (0.65) | PNMTTAAR1IDO1KDM4EALDH1A1 | |
| SCHEMBL42705 | 0.77 | PNMT (1.00) | PNMTTAAR1IDO1KDM4EALDH1A1 | |
| SCHEMBL29944235 | 0.76 | PNMT (0.41) | PNMTTAAR1IDO1ALDH1A1POLB | |
| SCHEMBL17450488 | 0.76 | GABRA1 (0.44) | PNMTTAAR1IDO1ALDH1A1 | |
| SCHEMBL15574616 | 0.76 | PNMT (0.58) | PNMTTAAR1IDO1KDM4EALDH1A1 | |
| SCHEMBL1145376 | 0.75 | PNMT (0.62) | PNMTTAAR1IDO1KDM4EALDH1A1 | |
| SCHEMBL12457076 | 0.75 | PNMT (0.62) | PNMTTAAR1IDO1KDM4EALDH1A1 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4059610-A | Process for preparing isocyanic acid derivatives | KAO SOAP CO., LTD. (JA) | 1977-11-22 | — | — | US | claimed |
| EP-1467974-B1 | BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS GNRH ANTAGONISTS | SOD CONSEILS RECH APPLIC (FR) | 2007-08-15 | — | — | EP | disclosed |
| CN-1294568-A | Fluorinating agent, process for producing same, and use thereof | MITSUI CHEMICALS INC (JP) | 2001-05-09 | — | — | CN | disclosed |
| EP-0092628-B1 | PROCESS FOR THE PREPARATION OF PHENYL KETONES STARTING FROM HALOGEN OR TRIHALOGEN METHYL BENZENES AND ALIPHATIC OR AROMATIC TRIHALOGEN-METHYL COMPOUNDS | RHONE-POULENC SPECIALITES CHIMIQUES (FR) | 1985-05-29 | — | — | EP | disclosed |
| EP-0084742-B1 | PROCESS FOR THE ACYLATION OF HALOGEN OR TRIHALOGEN METHYL BENZENES | RHONE-POULENC SPECIALITES CHIMIQUES (FR) | 1985-05-22 | — | — | EP | disclosed |
| US-4454350-A | Process for the acylation of halo- or trihalomethylbenzenes | RHONE-POULENC SPECIALITIES CHIMIQUES (FR) | 1984-06-12 | — | — | US | disclosed |
| US-4453012-A | REACTION OF A HALO OR TRIHALOMETHYL BENZENE WITH A TRIHALOMETHYLATED ALIPHATIC OR AROMATIC COMPOUND | RHONE-POULENC SPECIALITES CHIMIQUES (FR) | 1984-06-05 | — | — | US | disclosed |
| EP-0092628-A1 | Process for the preparation of phenyl ketones starting from halogen or trihalogen methyl benzenes and aliphatic or aromatic trihalogen-methyl compounds | RHONE-POULENC SPECIALITES CHIMIQUES (FR) | 1983-11-02 | — | — | EP | disclosed |
| EP-0084742-A1 | Process for the acylation of halogen or trihalogen methyl benzenes | RHONE-POULENC SPECIALITES CHIMIQUES (FR) | 1983-08-03 | — | — | EP | disclosed |
| US-4059610-A | Process for preparing isocyanic acid derivatives | KAO SOAP CO., LTD. (JA) | 1977-11-22 | — | — | US | disclosed |