Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL6907784 | 0.80 | PTGS2 (0.37) | PTGS2MAOAMAOBCYP11B2CYP11B1 | |
| SCHEMBL7423243 | 0.75 | PTGS2 (0.41) | PTGS2MAOAMAOBCYP11B2CYP11B1 | |
| SCHEMBL7034657 | 0.74 | PTGS2 (0.36) | PTGS2MAOAMAOBCYP11B2CYP11B1 | |
| SCHEMBL7031079 | 0.73 | PTGS2 (0.35) | PTGS2MAOAMAOBCYP11B2CYP11B1 | |
| SCHEMBL6908479 | 0.70 | PTGS2 (0.33) | PTGS2CYP11B2CYP11B1ACHE | |
| SCHEMBL704145 | 0.69 | CA4 (0.37) | — | |
| SCHEMBL8031056 | 0.69 | PTGS2 (0.53) | PTGS2MAOAMAOBCYP11B2CYP11B1 | |
| SCHEMBL5299965 | 0.68 | — | — | |
| SCHEMBL28720047 | 0.67 | CYP3A4 (0.30) | — | |
| SCHEMBL79874 | 0.66 | MAPK1 (0.37) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0880534-B1 | HETEROATOM SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION CATALYST SYSTEMS AND METHODS FOR PREPARING THEM | BOREALIS TECH OY (FI) | 2003-12-17 | — | — | EP | disclosed |
| CN-1089342-C | Heteroatom substituted metallocene compounds for olefin polymerization catalyst systems and methods for their preparation | BOREALIS AS (DK) | 2002-08-21 | — | — | CN | disclosed |
| US-6277778-B1 | COORDINATION CATALYSTS | BOREALIS A/S (DK) | 2001-08-21 | — | — | US | disclosed |
| CN-1214687-A | Heteroatom substituted metallocene compounds for polymerization catalyst system and method for preparing them | BOREALIS AS (DK) | 1999-04-21 | — | — | CN | disclosed |
| EP-0880534-A1 | HETEROATOM SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION CATALYST SYSTEMS AND METHODS FOR PREPARING THEM | BOREALIS A/S (DK) | 1998-12-02 | — | — | EP | disclosed |
| WO-1997028170-A1 | HETEROATOM SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION CATALYST SYSTEMS AND METHODS FOR PREPARING THEM | BOREALIS A/S (DK) | 1997-08-07 | — | — | WO | disclosed |