Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 6/20 | 0.41 |
| ▸ | LPAR1 | Q92633 | 3/20 | 0.41 |
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | FABP2 | P12104 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.36 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.36 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10089 | 0.91 | AKR1C3 (0.42) | PTGS2LPAR1LPAR3PTGS1MEN1 | |
| SCHEMBL9974 | 0.90 | LPAR1 (0.40) | LPAR1LPAR3MEN1KMT2AMAPT | |
| SCHEMBL9972 | 0.82 | LPAR1 (0.39) | PTGS2LPAR1LPAR3PTGS1MAPT | |
| SCHEMBL10449 | 0.80 | LPAR1 (0.46) | LPAR1LPAR3MEN1KMT2AMAPT | |
| SCHEMBL9784 | 0.78 | ABCC3 (0.42) | LPAR1MAPTCYP2C9LMNAABCC3 | |
| SCHEMBL10136 | 0.77 | AKT1 (0.42) | LPAR1MAPTCYP2C9TSHRLMNA | |
| SCHEMBL10090 | 0.76 | RXRA (0.38) | SLCO1B1 | |
| SCHEMBL9719 | 0.75 | LPAR1 (0.47) | LPAR1MEN1KMT2AMAPTCYP2C9 | |
| SCHEMBL11599 | 0.75 | LPAR1 (0.44) | LPAR1LPAR3CYP2C9AKR1C4AKR1C3 | |
| SCHEMBL10448 | 0.74 | LPAR1 (0.42) | LPAR1LPAR3MAPTCYP2C9AKR1C4 |
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-2483251-A2 | POLYCYCLIC COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS | Amira Pharmaceuticals, Inc. (US) | 2012-08-08 | — | — | EP | disclosed |
| WO-2011041462-A2 | POLYCYCLIC COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS | AMIRA PHARMACEUTICALS, INC. (US) | 2011-04-07 | — | — | WO | disclosed |