Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR7 | P34969 | 1/20 | 0.30 |
| ▸ | DRD3 | P35462 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 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 | |
|---|---|---|---|---|
| SCHEMBL1452101 | 0.86 | ACHE (0.41) | ACHECYP11B2PTGS2CYP11B1MAOA | |
| SCHEMBL8854215 | 0.84 | ACHE (0.40) | ACHECYP11B2PTGS2CYP11B1MAOA | |
| Hydrochloric Acid SCHEMBL6761124 | 0.83 | CYP11B2 (0.42) | ACHECYP11B2PTGS2CYP11B1MAOA | |
| Hydrochloric Acid SCHEMBL6761120 | 0.83 | ACHE (0.39) | ACHECYP11B2PTGS2CYP11B1MAOA | |
| SCHEMBL7937584 | 0.81 | ACHE (0.31) | ACHECYP11B2PTGS2CYP11B1 | |
| SCHEMBL1452421 | 0.77 | PTGS2 (0.33) | CYP11B2PTGS2CYP11B1 | |
| SCHEMBL15121440 | 0.75 | CYP11B2 (0.41) | ACHECYP11B2PTGS2CYP11B1MAOA | |
| SCHEMBL2743954 | 0.75 | CYP11B2 (0.41) | ACHECYP11B2PTGS2CYP11B1MAOA | |
| Hydrochloric Acid SCHEMBL7946663 | 0.75 | CYP11B2 (0.33) | CYP11B2PTGS2CYP11B1 | |
| Hydrochloric Acid SCHEMBL7943910 | 0.75 | CYP11B2 (0.33) | CYP11B2PTGS2CYP11B1 |
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-6248912-B1 | OF TRANSITION METALS HAVING A TETRAHYDROINDENYL LIGAND BONDED IN THE 2-POSITION | BAYER AKTIENGESELLSCHAFT (DE) | 2001-06-19 | — | — | US | disclosed |
| EP-0940408-A1 | Metalorganic compounds | Bayer Aktiengesellschaft (DE) | 1999-09-08 | — | — | EP | disclosed |
| EP-0940412-A1 | Atactic propylene (co)polymers | Bayer Aktiengesellschaft (DE) | 1999-09-08 | — | — | EP | disclosed |