Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 4/20 | 0.42 |
| ▸ | HTR2C | P28335 | 3/20 | 0.38 |
| ▸ | HTR2B | P41595 | 3/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10989854 | 0.86 | HTR2A (0.45) | HTR2AKDM1AMEN1TP53CYP3A4 | |
| SCHEMBL2235604 | 0.79 | SLC6A2 (0.55) | HTR2AHTR2CHTR2BHRH3MEN1 | |
| SCHEMBL8254519 | 0.79 | SLC6A2 (0.55) | HTR2AHTR2CHTR2BHRH3MEN1 | |
| SCHEMBL4288613 | 0.79 | SLC6A2 (0.55) | HTR2AHTR2CHTR2BHRH3MEN1 | |
| Hydrochloric Acid SCHEMBL5348264 | 0.78 | SLC6A2 (0.53) | HTR2AHTR2CHTR2BHRH3MEN1 | |
| SCHEMBL2513980 | 0.72 | SLC6A2 (0.36) | KDM1ARCOR1SLC6A2SLC6A3 | |
| SCHEMBL2513984 | 0.72 | SLC6A2 (0.36) | KDM1ARCOR1SLC6A2SLC6A3 | |
| SCHEMBL28623848 | 0.68 | SIGMAR1 (0.40) | HTR2AHTR2CHTR2BHRH3KDM1A | |
| SCHEMBL14804298 | 0.66 | HTR2A (0.54) | HTR2AHTR2CHTR2BHRH3KDM1A | |
| SCHEMBL10992704 | 0.65 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007041584-A2 | IMPLANTABLE SENSORS, IMPLANTABLE PUMPS, AND ANTI-SCARRING DRUG COMBINATIONS | COMBINATORX, INCORPORATED (US) | 2007-04-12 | — | — | WO | disclosed |
| WO-2007041593-A2 | ANTI-SCARRING DRUG COMBINATIONS AND USE THEREOF | COMBINATORX, INCORPORATED (US) | 2007-04-12 | — | — | WO | disclosed |