Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACKR3 | P25106 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 3/20 | 0.45 |
| ▸ | DRD2 | P14416 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28004590 | 0.88 | ACKR3 (0.51) | ACKR3EPHX2KMT2ANPC1HTR1A | |
| SCHEMBL28004501 | 0.84 | ACKR3 (0.50) | ACKR3HTR1ADRD2POLB | |
| SCHEMBL28004508 | 0.83 | ACKR3 (0.51) | ACKR3HTR1ADRD2 | |
| SCHEMBL28004463 | 0.83 | ACKR3 (0.51) | ACKR3HTR1ADRD2ALDH1A1 | |
| SCHEMBL28004883 | 0.83 | ACKR3 (0.51) | ACKR3ALDH1A1 | |
| SCHEMBL28004871 | 0.82 | ACKR3 (0.51) | ACKR3KMT2ATDP1HTR1ADRD2 | |
| SCHEMBL28004968 | 0.82 | ACKR3 (0.51) | ACKR3NPC1TDP1HTR1ADRD2 | |
| SCHEMBL28817720 | 0.81 | ACKR3 (0.52) | ACKR3HTR1ADRD2 | |
| SCHEMBL28004504 | 0.81 | ACKR3 (0.52) | ACKR3TDP1HTR1ADRD2ALDH1A1 | |
| SCHEMBL28004458 | 0.81 | ACKR3 (0.52) | ACKR3HTR1A |
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 |
|---|---|---|---|---|---|---|---|
| CN-104395302-A | 1- [ m-carboxamido (hetero) aryl-methyl ] -heterocyclyl-carboxamide derivatives | ACTELION PHARMACEUTICALS LTD | 2015-03-04 | — | — | CN | claimed |
| CN-104395302-A | 1- [ m-carboxamido (hetero) aryl-methyl ] -heterocyclyl-carboxamide derivatives | ACTELION PHARMACEUTICALS LTD | 2015-03-04 | — | — | CN | disclosed |