Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE7A | Q13946 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CCR6 | P51684 | 1/20 | 0.33 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.33 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | HTR1D | P28221 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | HTR5A | P47898 | 1/20 | 0.33 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18953512 | 0.86 | HTR1A (0.41) | PDE7AMAPTALDH1A1HSP90AA1PKM | |
| SCHEMBL18953701 | 0.79 | PDE7A (0.45) | PDE7AMAPTALDH1A1HSP90AA1MAPK1 | |
| SCHEMBL4686117 | 0.73 | SERPINH1 (0.35) | PDE7AMAPTALDH1A1HSP90AA1MAPK1 | |
| SCHEMBL18953654 | 0.73 | AKR1B1 (0.36) | PDE7AALDH1A1AKR1B1GRIN2DGRIN3B | |
| SCHEMBL18953588 | 0.67 | — | — | |
| SCHEMBL18953486 | 0.67 | CREBBP (0.33) | GRIN2DGRIN3BGRIN1GRIN2AGRIN2B | |
| SCHEMBL18953378 | 0.67 | IGF1R (0.37) | PDE3BPDE3AGRIN2DGRIN3BGRIN1 | |
| SCHEMBL10571070 | 0.66 | CRHBP (0.35) | PDE7AMAPTALDH1A1HSP90AA1PKM | |
| SCHEMBL18953531 | 0.64 | ALDH1A1 (0.38) | PDE7AALDH1A1HTR1AHTR1DHTR2C | |
| SCHEMBL18953724 | 0.62 | CREBBP (0.39) | PDE7AALDH1A1HTR1AHTR1DHTR2C |
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-2017098421-A1 | BENZOTHIADIAZINE COMPOUNDS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2017-06-15 | — | — | WO | disclosed |