Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 8/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.37 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6993375 | 0.84 | OPRM1 (0.43) | HTR1ADRD2ADRA1DADRA1AADRA1B | |
| SCHEMBL6998070 | 0.82 | HTR1A (0.44) | HTR1ADRD2ADRA1DADRA1AADRA1B | |
| SCHEMBL6995968 | 0.81 | HTR1A (0.51) | HTR1ADRD2KDM4EADRA1DADRA1A | |
| SCHEMBL6993063 | 0.81 | HTR1A (0.41) | HTR1ADRD2ADRA1DADRA1AADRA1B | |
| SCHEMBL6989660 | 0.80 | HTR1A (0.42) | HTR1ADRD2ADRA1DADRA1AADRA1B | |
| SCHEMBL6992477 | 0.80 | DRD2 (0.39) | HTR1ADRD2ADRA1DADRA1AADRA1B | |
| SCHEMBL7092290 | 0.79 | HTR1A (0.53) | HTR1ADRD2ADRA1DADRA1AADRA1B | |
| SCHEMBL6997280 | 0.78 | HTR1A (0.53) | HTR1ADRD2MEN1KMT2AADRA1D | |
| SCHEMBL6994228 | 0.78 | HTR1A (0.48) | HTR1ADRD2MEN1KMT2AKDM4E | |
| SCHEMBL6991651 | 0.77 | HTR1A (0.41) | HTR1ADRD2ADRA1DADRA1AADRA1B |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0927184-B1 | 3-SUBSTITUTED PYRIDO 4',3':4,5]THIENO 2,3-D]PYRIMIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE | ABBOTT GMBH & CO KG (DE) | 2003-10-22 | — | — | EP | disclosed |