Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 1/20 | 0.45 |
| ▸ | CPT2 | P23786 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | HMGCR | P04035 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | LDHA | P00338 | 1/20 | 0.33 |
| ▸ | SRR | Q9GZT4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11566635 | 0.84 | TDP1 (0.42) | FFAR1CPT2TDP1HMGCRCHRM1 | |
| SCHEMBL9577916 | 0.82 | HMGCR (0.39) | FFAR1CPT2TDP1HMGCRCHRM1 | |
| SCHEMBL974936 | 0.81 | FFAR1 (0.65) | FFAR1CPT2TDP1HMGCRCHRM1 | |
| SCHEMBL14139514 | 0.79 | TDP1 (0.43) | FFAR1CPT2TDP1KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL5669465 | 0.79 | FFAR1 (0.62) | FFAR1CPT2TDP1HMGCRCHRM1 | |
| SCHEMBL14269321 | 0.79 | MGAM (0.38) | FFAR1CPT2TDP1KDM4EALDH1A1 | |
| SCHEMBL5003832 | 0.78 | GAA (0.52) | KDM4EALDH1A1HDAC3HDAC1HDAC2 | |
| SCHEMBL20705535 | 0.77 | FFAR1 (0.60) | FFAR1CPT2TDP1HMGCRCHRM1 | |
| SCHEMBL13183349 | 0.76 | KDM4E (0.37) | FFAR1CPT2TDP1KDM4EALDH1A1 | |
| SCHEMBL8896826 | 0.74 | CES1 (0.42) | FFAR1CPT2TDP1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1003740-A2 | PYRROLIDINE-3-CARBOXYLIC ACID DERIVATIVES AND THEIR USE AS ENDOTHELIN ANTAGOISTS | Abbott Laboratories (US) | 2000-05-31 | — | — | EP | disclosed |
| WO-1999006397-A2 | PYRROLIDINE-3-CARBOXYLIC ACID DERIVATIVES AND THEIR USE AS ENDOTHELIN ANTAGONISTS | ABBOTT LABORATORIES (US) | 1999-02-11 | — | — | WO | disclosed |