Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 7/20 | 0.56 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.56 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.56 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.56 |
| ▸ | HTR2A | P28223 | 3/20 | 0.51 |
| ▸ | DRD2 | P14416 | 2/20 | 0.51 |
| ▸ | DRD3 | P35462 | 2/20 | 0.51 |
| ▸ | DRD4 | P21917 | 1/20 | 0.51 |
| ▸ | HTR2C | P28335 | 1/20 | 0.51 |
| ▸ | HTR7 | P34969 | 3/20 | 0.50 |
| ▸ | HTR6 | P50406 | 3/20 | 0.50 |
| ▸ | HTR5A | P47898 | 2/20 | 0.50 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.50 |
| ▸ | HTR3B | O95264 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | NCF1 | P14598 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | HTR1D | P28221 | 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 | |
|---|---|---|---|---|
| SCHEMBL15000801 | 0.86 | DRD2 (0.49) | HTR1ASLC6A2SLC6A4SLC6A3HTR2A | |
| SCHEMBL18756929 | 0.85 | HTR1A (0.53) | HTR1ASLC6A2SLC6A4SLC6A3HTR2A | |
| SCHEMBL18756980 | 0.85 | KMT2A (0.43) | HTR1ASLC6A2SLC6A4SLC6A3NCF1 | |
| SCHEMBL12525707 | 0.83 | AOC3 (0.48) | HTR1ASLC6A2SLC6A4SLC6A3HTR2A | |
| SCHEMBL14993244 | 0.83 | HTR1A (0.42) | HTR1ASLC6A2SLC6A4SLC6A3HTR2A | |
| SCHEMBL2384862 | 0.83 | ADRB1 (0.61) | HTR1ASLC6A2SLC6A4SLC6A3HTR2A | |
| SCHEMBL18756992 | 0.81 | HTR1A (0.53) | HTR1AHTR2ADRD2DRD3DRD4 | |
| SCHEMBL18756963 | 0.81 | AOC3 (0.38) | HTR1ASLC6A2SLC6A4SLC6A3HTR2A | |
| SCHEMBL671134 | 0.81 | LRRK2 (0.50) | NCF1TSHRHSD17B10KDM4EALDH1A1 | |
| SCHEMBL27664503 | 0.80 | HTR1A (0.51) | HTR1ASLC6A2SLC6A4SLC6A3HTR2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3002278-B1 | GUANIDINE COMPOUND | ASTELLAS PHARMA INC (JP) | 2017-04-19 | — | — | EP | disclosed |
| WO-2012124696-A1 | GUANIDINE COMPOUND | アステラス製薬株式会社 (JP) | 2012-09-20 | — | — | WO | disclosed |