Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | P2RY12 | Q9H244 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 2/20 | 0.31 |
| ▸ | HTR2C | P28335 | 2/20 | 0.31 |
| ▸ | HTR2B | P41595 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4458666 | 0.88 | PDE4B (0.46) | DPP4PDE4BPDE4APDE4CPDE4D | |
| SCHEMBL4458668 | 0.88 | PDE4B (0.46) | DPP4PDE4BPDE4APDE4CPDE4D | |
| SCHEMBL4480268 | 0.85 | USP30 (0.42) | SMN1; SMN2LMNAKDM4EALDH1A1 | |
| SCHEMBL4480273 | 0.85 | USP30 (0.42) | SMN1; SMN2LMNAKDM4EALDH1A1 | |
| SCHEMBL4464375 | 0.80 | PDE4B (0.40) | DPP4PDE4BSMN1; SMN2LMNAKDM4E | |
| SCHEMBL4464380 | 0.80 | PDE4B (0.40) | DPP4PDE4BSMN1; SMN2LMNAKDM4E | |
| SCHEMBL4480859 | 0.76 | MAPT (0.41) | SMN1; SMN2LMNAKDM4EALDH1A1 | |
| SCHEMBL4472753 | 0.65 | HTR2A (0.62) | DPP4HTR2AHTR2CHTR2B | |
| SCHEMBL4483372 | 0.65 | HTR2A (0.51) | DPP4HTR2AHTR2CHTR2BKDM4E | |
| SCHEMBL27042409 | 0.65 | CA12 (0.40) | SMN1; SMN2LMNAKDM4EALDH1A1 |
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-1778225-A2 | PYRROLO(OXO)ISOQUINOLINES AS 5HT LIGANDS | Bristol-Myers Squibb Company (US) | 2007-05-02 | — | — | EP | disclosed |
| WO-2006019886-A2 | PYRROLO(OXO)ISOQUINOLINES AS 5HT LIGANDS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2006-02-23 | — | — | WO | disclosed |