Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR3 | P49682 | 4/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | PDE10A | Q9Y233 | 4/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.47 |
| ▸ | G6PD | P11413 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7699242 | 0.90 | CXCR3 (0.48) | CXCR3ALDH1A1MEN1KMT2ACYP1A2 | |
| SCHEMBL7144891 | 0.88 | CXCR3 (0.62) | CXCR3PDE10A | |
| SCHEMBL5156390 | 0.85 | CXCR3 (0.46) | CXCR3KCNH2HRH3 | |
| SCHEMBL7010507 | 0.83 | HRH3 (0.64) | ALDH1A1MEN1KMT2ACYP1A2CYP3A4 | |
| SCHEMBL452172 | 0.83 | ALDH1A1 (0.61) | CXCR3ALDH1A1MEN1KMT2ACYP1A2 | |
| SCHEMBL12672493 | 0.80 | MAPT (0.54) | CXCR3ALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL451255 | 0.78 | ALDH1A1 (0.64) | CXCR3ALDH1A1MEN1KMT2ACYP1A2 | |
| SCHEMBL12672676 | 0.77 | PIK3CD (0.50) | CXCR3LMNAPDE10AKCNH2HRH3 | |
| SCHEMBL15457233 | 0.76 | C1R (0.45) | CXCR3ALDH1A1MEN1KMT2ACYP1A2 | |
| SCHEMBL1888478 | 0.76 | MAPT (0.52) | CXCR3ALDH1A1MEN1KMT2ALMNA |
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-1216232-A1 | HETEROCYCLIC COMPOUNDS AND METHODS FOR MODULATING CXCR3 FUNCTION | Chemocentryx, Inc. (US) | 2002-06-26 | — | — | EP | disclosed |
| WO-2001016114-A2 | HETEROCYCLIC COMPOUNDS AND METHODS FOR MODULATING CXCR3 FUNCTION | CHEMOCENTRYX, INC. (US) | 2001-03-08 | — | — | WO | disclosed |