Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.49 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.49 |
| ▸ | CHRNB2 | P17787 | 5/20 | 0.49 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.49 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.49 |
| ▸ | CHRNA5 | P30532 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | CHRNB4 | P30926 | 3/20 | 0.43 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.40 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.40 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 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 | |
|---|---|---|---|---|
| SCHEMBL6314845 | 0.97 | CHRNB2 (0.52) | KCNH2MCHR1CHRNB2CHRNA4CHRNA7 | |
| SCHEMBL6651622 | 0.85 | KDM4E (0.41) | KCNH2MCHR1CHRNB2CHRNA4CHRNA7 | |
| SCHEMBL6316638 | 0.82 | MAOA (0.45) | CHRNB2CHRNA4CHRNA7CHRNA5KDM4E | |
| SCHEMBL6316855 | 0.80 | HTT (0.53) | KCNH2MCHR1KDM4ELMNAMAPT | |
| SCHEMBL6314855 | 0.80 | NPC1 (0.54) | KDM4EHTTALDH1A1 | |
| SCHEMBL6321908 | 0.80 | HTT (0.53) | KCNH2MCHR1KDM4EHTTALDH1A1 | |
| SCHEMBL6316318 | 0.80 | HTT (0.53) | KCNH2MCHR1KDM4EHTTALDH1A1 | |
| SCHEMBL6323878 | 0.79 | KDM4E (0.55) | KDM4EHTTALDH1A1 | |
| SCHEMBL6323053 | 0.78 | SPHK1 (0.44) | MCHR1KDM4EGAALMNASPHK2 | |
| SCHEMBL6323062 | 0.78 | SPHK1 (0.44) | MCHR1KDM4EGAALMNASPHK2 |
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-1377549-A1 | FUNCTIONALIZED HETEROCYCLES AS MODULATORS OF CHEMOKINE RECEPTOR FUNCTION AND METHODS OF USE THEREFOR | Millennium Pharmaceuticals, Inc. (US) | 2004-01-07 | — | — | EP | disclosed |
| WO-2002072549-A1 | FUNCTIONALIZED HETEROCYCLES AS MODULATORS OF CHEMOKINE RECEPTOR FUNCTION AND METHODS OF USE THEREFOR | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2002-09-19 | — | — | WO | disclosed |