Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.67 |
| ▸ | HTR2C | P28335 | 1/20 | 0.67 |
| ▸ | HTR2B | P41595 | 1/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | MC4R | P32245 | 2/20 | 0.49 |
| ▸ | MC5R | P33032 | 2/20 | 0.49 |
| ▸ | TACR1 | P25103 | 2/20 | 0.48 |
| ▸ | MC3R | P41968 | 1/20 | 0.46 |
| ▸ | MME | P08473 | 2/20 | 0.43 |
| ▸ | ACE | P12821 | 2/20 | 0.43 |
| ▸ | CPA1 | P15085 | 2/20 | 0.43 |
| ▸ | ACE2 | Q9BYF1 | 2/20 | 0.43 |
| ▸ | DPP4 | P27487 | 1/20 | 0.43 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.43 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.43 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL17413319 | 0.80 | HTR2A (1.00) | HTR2AHTR2CHTR2BCYP1A2CYP2A6 | |
| SCHEMBL11748582 | 0.80 | HTR2A (0.67) | HTR2AHTR2CHTR2BCYP1A2CYP2A6 | |
| SCHEMBL31054190 | 0.80 | HTR2A (1.00) | HTR2AHTR2CHTR2BCYP1A2CYP2A6 | |
| SCHEMBL31054149 | 0.80 | HTR2A (1.00) | HTR2AHTR2CHTR2BCYP1A2CYP2A6 | |
| SCHEMBL268036 | 0.80 | HTR2A (1.00) | HTR2AHTR2CHTR2BCYP1A2CYP2A6 | |
| Hydrochloric Acid SCHEMBL5962875 | 0.78 | HTR2A (0.96) | HTR2AHTR2CHTR2BCYP1A2CYP2A6 | |
| SCHEMBL3470527 | 0.78 | HTR2A (0.65) | HTR2AHTR2CHTR2BCYP1A2CYP2A6 | |
| SCHEMBL5168955 | 0.78 | HTR2A (0.65) | HTR2AHTR2CHTR2BCYP1A2CYP2A6 | |
| SCHEMBL1127612 | 0.77 | HTR2A (0.53) | HTR2AHTR2CHTR2BCYP1A2CYP2A6 | |
| SCHEMBL17407614 | 0.77 | HTR2A (0.73) | HTR2AHTR2CHTR2BCYP1A2CYP2A6 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3027787-A2 | ORGANIC DISULFIDE BASED CORROSION INHIBITORS | Ecolab USA Inc. (US) | 2016-06-08 | — | — | EP | claimed |
| EP-3027787-A2 | ORGANIC DISULFIDE BASED CORROSION INHIBITORS | Ecolab USA Inc. (US) | 2016-06-08 | — | — | EP | disclosed |
| EP-1368509-A4 | COMPOSITION AND METHOD FOR INHIBITION OF METAL CORROSION | DONLAR CORP (US) | 2007-08-01 | — | — | EP | disclosed |
| EP-1368509-A2 | COMPOSITION AND METHOD FOR INHIBITION OF METAL CORROSION | DONLAR CORPORATION (US) | 2003-12-10 | — | — | EP | disclosed |
| WO-2000075399-A2 | COMPOSITION AND METHOD FOR INHIBITION OF METAL CORROSION | DONLAR CORPORATION (US) | 2000-12-14 | — | — | WO | disclosed |