Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 4/20 | 0.47 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.35 |
| ▸ | FLT3 | P36888 | 1/20 | 0.35 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.35 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.35 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.35 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.35 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.35 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18896009 | 0.88 | CCR1 (0.48) | CCR1CHRM2CCR5 | |
| SCHEMBL12936669 | 0.84 | CCR1 (0.49) | CCR1CHRM2CCR5 | |
| SCHEMBL656521 | 0.80 | CCR1 (0.72) | CCR1CNR1CNR2GPR55FLT3 | |
| SCHEMBL656522 | 0.80 | CCR1 (0.72) | CCR1CNR1CNR2GPR55FLT3 | |
| SCHEMBL14580314 | 0.80 | CCR1 (0.72) | CCR1CNR1CNR2GPR55FLT3 | |
| SCHEMBL15478333 | 0.78 | DRD2 (0.40) | CCR1DRD2 | |
| SCHEMBL15478403 | 0.76 | DRD2 (0.36) | CCR1NPC1ALDH1A1DRD2RAB9A | |
| SCHEMBL15478355 | 0.76 | CCR1 (0.38) | CCR1DRD2 | |
| SCHEMBL15478359 | 0.76 | CCR1 (0.38) | CCR1DRD2 | |
| SCHEMBL15478375 | 0.76 | CCR1 (0.50) | CCR1TP53TSHRDRD2CHRM2 |
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 |
|---|---|---|---|---|---|---|---|
| US-9663537-B2 | Chemokine receptor antagonists and methods of use | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2017-05-30 | — | — | US | disclosed |