Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR3 | P49682 | 3/20 | 0.83 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.83 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 1/20 | 0.41 |
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3732781 | 0.91 | CXCR3 (0.78) | CXCR3KCNH2ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL3732650 | 0.91 | CXCR3 (0.96) | CXCR3KCNH2ALDH1A1LMNAKMT2A | |
| SCHEMBL3730735 | 0.91 | CXCR3 (0.88) | CXCR3KCNH2ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL3735739 | 0.91 | CXCR3 (0.88) | CXCR3KCNH2ALDH1A1LMNAKMT2A | |
| SCHEMBL112559 | 0.91 | CXCR3 (1.00) | CXCR3KCNH2ALDH1A1LMNAKMT2A | |
| SCHEMBL114424 | 0.90 | CXCR3 (0.75) | CXCR3KCNH2ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL3809576 | 0.89 | CXCR3 (0.78) | CXCR3KCNH2ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL3740353 | 0.89 | CXCR3 (0.85) | CXCR3KCNH2ALDH1A1LMNAKMT2A | |
| SCHEMBL3726591 | 0.89 | CXCR3 (0.84) | CXCR3KCNH2ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL3742966 | 0.89 | CXCR3 (0.84) | CXCR3KCNH2ALDH1A1LMNAKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2424840-B1 | CXCR3 RECEPTOR ANTAGONISTS | BOEHRINGER INGELHEIM INT (DE) | 2014-08-06 | — | — | EP | disclosed |