Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 4/20 | 0.39 |
| ▸ | CES1 | P23141 | 4/20 | 0.39 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.38 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.38 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.38 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18837647 | 0.93 | CA2 (0.41) | CA2FFAR4CES2CES1SMN1; SMN2 | |
| SCHEMBL3307047 | 0.93 | CA2 (0.48) | CA2FFAR4FFAR1LMNACES2 | |
| SCHEMBL16702733 | 0.93 | CA2 (0.48) | CA2FFAR4FFAR1LMNACES2 | |
| SCHEMBL7666492 | 0.93 | CA2 (0.48) | CA2FFAR4FFAR1LMNACES2 | |
| SCHEMBL10519624 | 0.93 | CA2 (0.48) | CA2FFAR4FFAR1LMNACES2 | |
| SCHEMBL23498813 | 0.93 | CA2 (0.48) | CA2FFAR4FFAR1LMNACES2 | |
| SCHEMBL7767174 | 0.93 | CA2 (0.48) | CA2FFAR4FFAR1LMNACES2 | |
| SCHEMBL16209868 | 0.93 | CA2 (0.48) | CA2FFAR4FFAR1LMNACES2 | |
| SCHEMBL7511263 | 0.93 | CA2 (0.48) | CA2FFAR4FFAR1LMNACES2 | |
| SCHEMBL15019100 | 0.93 | CA2 (0.48) | CA2FFAR4FFAR1LMNACES2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3066065-A1 | CATALYTIC HYDROGENATION FOR PRODUCING AMINES FROM CARBOXYLIC ACID AMIDES, CARBOXYLIC ACID DIAMIDES, DI-, TRI-, OR POLYPEPETIDES, OR PEPTIDE AMIDES | Evonik Degussa GmbH (DE) | 2016-09-14 | — | — | EP | disclosed |
| WO-2015067450-A1 | CATALYTIC HYDROGENATION FOR PRODUCING AMINES FROM CARBOXYLIC ACID AMIDES, CARBOXYLIC ACID DIAMIDES, DI-, TRI-, OR POLYPEPETIDES, OR PEPTIDE AMIDES | EVONIK INDUSTRIES AG (DE) | 2015-05-14 | — | — | WO | disclosed |
| WO-2011149778-A1 | SYNTHETIC OLIGOSACCHARIDES FOR NEISSERIA MENINGITIS VACCINE | ANCORA PHARMACEUTICALS INC. (US) | 2011-12-01 | — | — | WO | disclosed |
| EP-2370443-A1 | DIHYDROETORPHINES AND THEIR PREPARATION | Euro-Celtique S.A. (LU) | 2011-10-05 | — | — | EP | disclosed |
| WO-2010067101-A1 | DIHYDROETORPHINES AND THEIR PREPARATION | EURO-CELTIQUE S.A. (LU) | 2010-06-17 | — | — | WO | disclosed |