Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 2/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | JAK1 | P23458 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | SLC26A6 | Q9BXS9 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7532 | 0.92 | ALOX5 (0.35) | CHRM1ALDH1A1SMN1; SMN2KDM4EHPGD | |
| SCHEMBL6765 | 0.91 | BRD4 (0.33) | ALDH1A1JAK2JAK1SMN1; SMN2KDM4E | |
| SCHEMBL7148 | 0.91 | ALDH1A1 (0.38) | CHRM1HTR2AMCHR1ALDH1A1FFAR4 | |
| SCHEMBL6153 | 0.89 | GAA (0.36) | ALDH1A1FFAR4JAK2JAK1GAA | |
| SCHEMBL1323 | 0.88 | OPRM1 (0.44) | CHRM1HTR2AMCHR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL6973 | 0.87 | BRD4 (0.36) | CHRM1ALDH1A1SMN1; SMN2KDM4EHPGD | |
| SCHEMBL7572 | 0.86 | SLC26A6 (0.36) | ALDH1A1SMN1; SMN2GAAPOLBLMNA | |
| SCHEMBL7632 | 0.86 | KMT2A (0.38) | ALDH1A1SMN1; SMN2KDM4EGAAPOLB | |
| SCHEMBL6236 | 0.85 | GAA (0.34) | GAA | |
| SCHEMBL11897090 | 0.84 | HDAC1 (0.36) | ALDH1A1SMN1; SMN2KDM4ETP53MAPT |
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-2483252-A2 | COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS | Amira Pharmaceuticals, Inc. (US) | 2012-08-08 | — | — | EP | disclosed |
| WO-2011041694-A2 | COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS | AMIRA PHARMACEUTICALS, INC. (US) | 2011-04-07 | — | — | WO | disclosed |