Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 2/20 | 1.00 |
| ▸ | XDH | P47989 | 1/20 | 0.61 |
| ▸ | MEN1 | O00255 | 2/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 1/20 | 0.60 |
| ▸ | HPGD | P15428 | 1/20 | 0.60 |
| ▸ | RECQL | P46063 | 1/20 | 0.60 |
| ▸ | FTO | Q9C0B1 | 3/20 | 0.54 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.53 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.53 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | COMT | P21964 | 1/20 | 0.53 |
| ▸ | EGFR | P00533 | 1/20 | 0.50 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Nitecapone SCHEMBL30489171 | 1.00 | GPR35 (1.00) | GPR35XDHMEN1KMT2AALDH1A1 | |
| Nitecapone SCHEMBL128420 | 1.00 | GPR35 (1.00) | GPR35XDHMEN1KMT2AALDH1A1 | |
| SCHEMBL8028708 | 0.92 | GPR35 (0.85) | GPR35XDHMEN1KMT2AALDH1A1 | |
| SCHEMBL7279195 | 0.88 | GPR35 (0.78) | GPR35XDHMEN1KMT2AALDH1A1 | |
| SCHEMBL7279188 | 0.88 | GPR35 (0.78) | GPR35XDHMEN1KMT2AALDH1A1 | |
| SCHEMBL8848344 | 0.86 | GPR35 (0.76) | GPR35XDHMEN1KMT2AALDH1A1 | |
| Tolcapone SCHEMBL4391775 | 0.84 | TTR (0.73) | GPR35XDHMEN1KMT2AALDH1A1 | |
| Nitecapone SCHEMBL6835167 | 0.83 | GPR35 (0.70) | GPR35XDHMEN1KMT2AALDH1A1 | |
| SCHEMBL7279215 | 0.82 | GPR35 (0.70) | GPR35MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL7287709 | 0.82 | GPR35 (0.70) | GPR35XDHMEN1KMT2AALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0964678-B1 | USE OF COMT INHIBITORS FOR THE MANUFACTURE OF A MEDICAMENT FOR THE PREVENTION OF DIABETIC VASCULAR DYSFUNCTIONS | ORION YHTYMAE OYJ (FI) | 2003-03-19 | — | — | EP | disclosed |
| US-6207706-B1 | ADMINISTERING CATECHOL-O-METHYL TRANSFERASE (COMT) INHIBITORS FOR THERAPY AND PROPHYLAXIS OF DIABETIC VASCULAR DYSFUNCTIONS SUCH AS NEPHROPATHY, RETINOPATHY AND NEUROPATHY | ORION-YHTYMA OYJ (FI) | 2001-03-27 | — | — | US | disclosed |
| EP-0964678-A1 | USE OF COMT INHIBITORS FOR THE MANUFACTURE OF A MEDICAMENT FOR THE PREVENTION OF DIABETIC VASCULAR DYSFUNCTIONS | Orion-yhtymä Oyj (FI) | 1999-12-22 | — | — | EP | disclosed |
| WO-1998027973-A1 | USE OF COMT INHIBITORS FOR THE MANUFACTURE OF A MEDICAMENT FOR THE PREVENTION OF DIABETIC VASCULAR DYSFUNCTIONS | Orion-Yhtymä Oyj (FI) | 1998-07-02 | — | — | WO | disclosed |