Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.40 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.40 |
| ▸ | CACNA2D1 | P54289 | 10/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | DRD1 | P21728 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | PAOX | Q6QHF9 | 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 | |
|---|---|---|---|---|
| SCHEMBL441038 | 0.76 | SIGMAR1 (0.43) | SIGMAR1PLA2G1BPLA2G2ACACNA2D1NPSR1 | |
| Ammonia Solution, Strong SCHEMBL17473691 | 0.75 | OPRM1 (0.48) | SIGMAR1PLA2G1BPLA2G2ACACNA2D1NPSR1 | |
| SCHEMBL8618063 | 0.74 | SIGMAR1 (0.42) | SIGMAR1PLA2G1BPLA2G2ACACNA2D1NPSR1 | |
| SCHEMBL5948920 | 0.74 | SIGMAR1 (0.42) | SIGMAR1PLA2G1BPLA2G2ACACNA2D1NPSR1 | |
| SCHEMBL8620075 | 0.74 | SIGMAR1 (0.42) | SIGMAR1PLA2G1BPLA2G2ACACNA2D1NPSR1 | |
| SCHEMBL23451697 | 0.74 | SIGMAR1 (0.42) | SIGMAR1PLA2G1BPLA2G2ACACNA2D1NPSR1 | |
| SCHEMBL1147030 | 0.74 | SIGMAR1 (0.42) | SIGMAR1PLA2G1BPLA2G2ACACNA2D1NPSR1 | |
| SCHEMBL1147313 | 0.74 | PLA2G1B (0.56) | SIGMAR1PLA2G1BPLA2G2ACACNA2D1NPSR1 | |
| SCHEMBL23451784 | 0.74 | SIGMAR1 (0.42) | SIGMAR1PLA2G1BPLA2G2ACACNA2D1NPSR1 | |
| SCHEMBL8618058 | 0.74 | SIGMAR1 (0.42) | SIGMAR1PLA2G1BPLA2G2ACACNA2D1NPSR1 |
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-5851946-A | Coordination catalyst systems comprising intramolecularly stabilized organometallic compounds | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-12-22 | — | — | US | disclosed |
| EP-0690748-B1 | COORDINATION CATALYST SYSTEMS CONTAINING INTRAMOLECULARLY STABILIZED ORGANOMETALLIC COMPOUNDS | MERCK PATENT GMBH (DE) | 1996-12-18 | — | — | EP | disclosed |
| EP-0399190-A1 | Organometallic compounds of aluminium, gallium and indium for the manufacture of semiconductors and their use | MERCK PATENT GmbH (DE) | 1990-11-28 | — | — | EP | disclosed |