Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 2/20 | 0.36 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.32 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.32 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.30 |
| ▸ | TUBB | P07437 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30406469 | 0.81 | MEN1 (0.36) | HTR1ADRD2ADRB2CYP1A2CYP3A4 | |
| SCHEMBL25421574 | 0.81 | MEN1 (0.36) | HTR1ADRD2ADRB2CYP1A2CYP3A4 | |
| SCHEMBL16031335 | 0.79 | STING1 (0.38) | HTR1ADRD2ADRB2CYP1A2CYP3A4 | |
| SCHEMBL30405780 | 0.74 | ALDH1A1 (0.38) | HTR1ADRD2ADRB2CYP1A2CYP3A4 | |
| SCHEMBL25421875 | 0.74 | ALDH1A1 (0.38) | HTR1ADRD2ADRB2CYP1A2CYP3A4 | |
| SCHEMBL19369444 | 0.73 | HTR1A (0.41) | HTR1ADRD2ADRB2CYP1A2CYP3A4 | |
| SCHEMBL17522629 | 0.70 | PTGDR (0.38) | HTR1ADRD2ADRB2CYP1A2CYP3A4 | |
| SCHEMBL20259615 | 0.69 | HTR1A (0.38) | HTR1ADRD2ADRB2CYP1A2CYP3A4 | |
| SCHEMBL20504885 | 0.68 | ADRB2 (0.52) | ADRB2CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL28812480 | 0.68 | AOC3 (0.38) | CYP1A2KDM4EALDH1A1MAPTTSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014164543-A1 | COMPOSITIONS COMPRISING THIENOPYRIMIDINE AND THIENOPYRIDINE COMPOUNDS AND METHODS OF USE THEREOF | THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) | 2014-10-09 | — | — | WO | disclosed |