Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.30 |
| ▸ | MAOA | P21397 | 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 | |
|---|---|---|---|---|
| SCHEMBL11769273 | 0.85 | HTR6 (0.33) | HTR6CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL6626052 | 0.83 | HTR6 (0.37) | HTR6CES1MAOA | |
| SCHEMBL5702808 | 0.83 | PTPN1 (0.39) | HTR6CES1MAOA | |
| SCHEMBL30084467 | 0.83 | PTPN1 (0.39) | HTR6CES1MAOA | |
| SCHEMBL27547777 | 0.80 | HTR6 (0.35) | HTR6CES1MAOA | |
| SCHEMBL30084478 | 0.77 | CHRM2 (0.41) | HTR6CYP2D6HSD17B10 | |
| SCHEMBL20996203 | 0.77 | CHRM2 (0.41) | HTR6CYP2D6HSD17B10 | |
| SCHEMBL20996272 | 0.77 | TSHR (0.41) | HTR6 | |
| SCHEMBL30084546 | 0.77 | TSHR (0.41) | HTR6 | |
| SCHEMBL11772381 | 0.77 | HTR6 (0.33) | HTR6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20030036612-A1 | Hetero cyclic metallocene compounds and use thereof in catalyst system for producing olefin polymers | BASELL POLYOLEFINE GMBH (DE) | 2003-02-20 | — | — | US | disclosed |
| EP-1157027-A1 | HETEROCYCLIC METALLOCENE COMPOUNDS AND USE THEREOF IN CATALYST SYSTEMS FOR PRODUCING OLEFIN POLYMERS | Basell Technology Company B.V. (NL) | 2001-11-28 | — | — | EP | disclosed |
| WO-2001047939-A1 | HETEROCYCLIC METALLOCENE COMPOUNDS AND USE THEREOF IN CATALYST SYSTEMS FOR PRODUCING OLEFIN POLYMERS | BASELL TECHNOLOGY COMPANY B.V. (NL) | 2001-07-05 | — | — | WO | disclosed |