Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 13/20 | 0.80 |
| ▸ | HTR2C | P28335 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | XDH | P47989 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | STAT3 | P40763 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL6803781 | 0.89 | MCHR1 (1.00) | MCHR1HTR2CMEN1KMT2A | |
| SCHEMBL6926100 | 0.87 | MCHR1 (0.64) | MCHR1HTR2CMAPTRAB9ASMN1; SMN2 | |
| SCHEMBL6921824 | 0.86 | MCHR1 (0.81) | MCHR1MAPTKDM4EALDH1A1TSHR | |
| SCHEMBL6801515 | 0.84 | MCHR1 (0.80) | MCHR1HTR2CRAB9AMEN1KMT2A | |
| SCHEMBL6922691 | 0.84 | MCHR1 (0.75) | MCHR1HTR2CMAPTKDM4EALDH1A1 | |
| SCHEMBL6927755 | 0.84 | MCHR1 (0.75) | MCHR1HTR2CMAPTKDM4EALDH1A1 | |
| SCHEMBL6922101 | 0.84 | MCHR1 (0.75) | MCHR1HTR2CMAPTKDM4EALDH1A1 | |
| SCHEMBL6924942 | 0.83 | MCHR1 (0.75) | MCHR1HTR2C | |
| SCHEMBL6926388 | 0.83 | MCHR1 (0.73) | MCHR1HTR2CMAPTKDM4EALDH1A1 | |
| SCHEMBL6807981 | 0.82 | MCHR1 (0.83) | MCHR1HTR2CRAB9AMEN1KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6515027-B1 | Ligands, agonists or antagonists, of the CC chemokine receptor CC-CKR5 | SMITHKLINE BEECHAM CORP. | 2003-02-04 | — | — | US | disclosed |
| EP-1001766-A4 | COMPOUNDS AND METHODS | SMITHKLINE BEECHAM CORP (US) | 2001-04-04 | — | — | EP | disclosed |
| EP-1001766-A1 | COMPOUNDS AND METHODS | SMITHKLINE BEECHAM CORPORATION (US) | 2000-05-24 | — | — | EP | disclosed |
| WO-1999001127-A1 | COMPOUNDS AND METHODS | SMITHKLINE BEECHAM CORPORATION (US) | 1999-01-14 | — | — | WO | disclosed |