Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 5/20 | 0.34 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.33 |
| ▸ | RET | P07949 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15478382 | 0.76 | HRH1 (0.34) | CCR1HRH1LMNASLC6A2CYP1A2 | |
| SCHEMBL15478326 | 0.74 | CCR1 (0.58) | CCR1HRH1TBXA2RCHRM2 | |
| SCHEMBL18633703 | 0.72 | CCR1 (0.32) | CCR1HRH1TBXA2R | |
| SCHEMBL18633704 | 0.69 | CCR1 (0.34) | CCR1HRH1TBXA2R | |
| SCHEMBL13824505 | 0.69 | CCR1 (0.32) | CCR1HRH1TBXA2R | |
| SCHEMBL18633833 | 0.69 | CCR1 (0.42) | CCR1HRH1LMNACYP3A4TP53 | |
| SCHEMBL12121948 | 0.67 | CCR1 (0.68) | CCR1HRH1TBXA2RLMNACYP3A4 | |
| SCHEMBL15478321 | 0.66 | CCR1 (0.43) | CCR1HRH1LMNACYP3A4TP53 | |
| SCHEMBL12936668 | 0.65 | CCR1 (0.43) | CCR1HRH1CYP3A4TP53CYP1A2 | |
| SCHEMBL18896008 | 0.63 | HRH3 (0.31) | — |
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 |