Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 2/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8375768 | 0.80 | TSHR (0.46) | TSHRCYP1A2CYP2C19CYP2C9ALDH1A1 | |
| SCHEMBL11237111 | 0.79 | TSHR (0.50) | TSHRCYP1A2CYP2C19CYP2C9ALDH1A1 | |
| SCHEMBL7476372 | 0.77 | TSHR (0.48) | TSHRCYP1A2CYP2C19CYP2C9ALDH1A1 | |
| SCHEMBL8376477 | 0.77 | TSHR (0.42) | TSHRCYP1A2CYP2C19CYP2C9TDP1 | |
| SCHEMBL1829396 | 0.76 | TSHR (0.52) | TSHRCYP1A2CYP2C19CYP2C9ALDH1A1 | |
| SCHEMBL15228184 | 0.75 | TSHR (0.46) | TSHRCYP1A2CYP2C19CYP2C9ALDH1A1 | |
| Hydrochloric Acid SCHEMBL11308929 | 0.75 | TSHR (0.46) | TSHRCYP1A2CYP2C19CYP2C9ALDH1A1 | |
| SCHEMBL10546410 | 0.75 | TSHR (0.46) | TSHRCYP1A2CYP2C19CYP2C9ALDH1A1 | |
| SCHEMBL9229930 | 0.75 | TSHR (0.44) | TSHRCYP2C19CYP2C9ALDH1A1TDP1 | |
| SCHEMBL6685341 | 0.74 | TSHR (0.50) | TSHRCYP1A2CYP2C19ALDH1A1KCNN4 |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105087662-A | Method for producing chiral chlorphenyl chlorethanol by use of yeast | UNIV QINGDAO SCIENCE & TECHNOLOGY | 2015-11-25 | — | — | CN | disclosed |
| CN-105063103-A | Method for producing chiral phenyl dichloroethanol with molds | UNIV QINGDAO SCIENCE & TECHNOLOGY | 2015-11-18 | — | — | CN | disclosed |
| US-6005116-A | HAVE INHIBITION ACTIVITIES AGAINST TYPE A-MONOAMINE OXIDASE; TREATING OR PREVENTING DEPRESSION, PARKINSON'S DISEASE, ALZEHEIMER'S DEMENTIA, OR CEREBROVASCULAR DEMENTIA | SANKYO COMPANY, LIMITED (JP) | 1999-12-21 | — | — | US | disclosed |
| EP-0885891-A1 | ISOXAZOLE DERIVATIVES | SANKYO COMPANY LIMITED (JP) | 1998-12-23 | — | — | EP | disclosed |
| US-5244884-A | Tripeptide | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1993-09-14 | — | — | US | disclosed |
| EP-0226641-B1 | OXODIAZINE COMPOUNDS | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1989-10-18 | — | — | EP | disclosed |
| US-4713381-A | ANTICOAGULANTS, ANALGESICS, ANTIINFLAMMATORY AGENT | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1987-12-15 | — | — | US | disclosed |
| EP-0226641-A1 | OXODIAZINE COMPOUNDS. | YOSHITOMI PHARMACEUTICAL (JP) | 1987-07-01 | — | — | EP | disclosed |
| WO-1986007059-A2 | OXODIAZINE COMPOUNDS | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1986-12-04 | — | — | WO | disclosed |
| US-4064239-A | LIVER FLUKES | MERCK & CO., INC. (US) | 1977-12-20 | — | — | US | disclosed |
| US-3966900-A | INSECTICIDES | AIRWICK INDUSTRIES, INC. (US) | 1976-06-29 | — | — | US | disclosed |