Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 13/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HTR5A | P47898 | 1/20 | 0.37 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.37 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.37 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6475419 | 0.87 | HTR2A (0.55) | HTR2AHTR2CTAAR1PARP1KDM4E | |
| Hydrochloric Acid SCHEMBL6484759 | 0.83 | HTR2A (0.51) | HTR2AHTR2CTAAR1PARP1KDM4E | |
| SCHEMBL6474333 | 0.83 | HTR2A (0.48) | HTR2AHTR2CTAAR1PARP1 | |
| Hydrochloric Acid SCHEMBL6476124 | 0.83 | HTR2A (0.44) | HTR2AHTR2CTAAR1PARP1SIRT2 | |
| Hydrochloric Acid SCHEMBL6474278 | 0.82 | HTR2C (0.47) | HTR2AHTR2CTAAR1PARP1 | |
| Hydrochloric Acid SCHEMBL6482040 | 0.82 | HTR2C (0.47) | HTR2AHTR2CTAAR1PARP1 | |
| Hydrochloric Acid SCHEMBL6475337 | 0.80 | HTR2A (0.44) | HTR2AHTR2CTAAR1PARP1KDM4E | |
| Hydrochloric Acid SCHEMBL6474295 | 0.80 | HTR2A (0.47) | HTR2AHTR2CTAAR1PARP1KDM4E | |
| Hydrochloric Acid SCHEMBL6476086 | 0.79 | PARP1 (0.55) | HTR2AHTR2CTAAR1PARP1SIRT2 | |
| Hydrochloric Acid SCHEMBL6473913 | 0.79 | PARP1 (0.55) | HTR2AHTR2CTAAR1PARP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1319004-A2 | SUBSTITUTED AZEPINO[4,5-B]INDOLE DERIVATIVES | PHARMACIA & UPJOHN COMPANY (US) | 2003-06-18 | — | — | EP | disclosed |
| EP-1319005-A2 | SUBSTITUTED AZEPINO[4,5-B]INDOLINE DERIVATIVES | PHARMACIA & UPJOHN COMPANY (US) | 2003-06-18 | — | — | EP | disclosed |
| WO-2002024701-A2 | SUBSTITUTED AZEPINO[4,5B)INDOLE DERIVATIVES | PHARMACIA & UPJOHN COMPANY (US) | 2002-03-28 | — | — | WO | disclosed |
| WO-2002024700-A2 | SUBSTITUTED AZEPINO[4,5b]INDOLINE DERIVATIVES | PHARMACIA & UPJOHN COMPANY (US) | 2002-03-28 | — | — | WO | disclosed |