Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.41 |
| ▸ | CCR5 | P51681 | 1/20 | 0.41 |
| ▸ | CCR8 | P51685 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 3/20 | 0.39 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.35 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.35 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18015281 | 0.87 | GRM5 (0.35) | CCR1CCR5CCR8PTGS1PTGS2 | |
| SCHEMBL18573263 | 0.86 | CCR1 (0.53) | CCR1CCR5CCR8ADORA2AADORA1 | |
| SCHEMBL19794394 | 0.78 | KDM4E (0.52) | CCR1CCR5CCR8GRM5TGFBR1 | |
| SCHEMBL21662030 | 0.76 | GRM5 (0.48) | CCR1CCR5CCR8GRM5L3MBTL1 | |
| SCHEMBL19833337 | 0.76 | CCR1 (0.45) | CCR1CCR5CCR8ADORA2AADORA1 | |
| SCHEMBL25070279 | 0.75 | TGFBR1 (0.49) | CCR1CCR5CCR8GRM5TGFBR1 | |
| SCHEMBL19933715 | 0.75 | CCR1 (0.47) | CCR1CCR5CCR8ADORA2AADORA1 | |
| SCHEMBL23018858 | 0.75 | CCR1 (0.44) | CCR1CCR5CCR8ADORA2AADORA1 | |
| SCHEMBL20696641 | 0.74 | ABL1 (0.53) | CCR1CCR5CCR8PTGS1PTGS2 | |
| SCHEMBL16352566 | 0.73 | CCR1 (0.64) | CCR1CCR5CCR8ADORA2AADORA1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017032439-A1 | METAL COMPLEXES | MERCK PATENT GMBH (DE) | 2017-03-02 | — | — | WO | disclosed |