Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | PRMT5 | O14744 | 7/20 | 0.41 |
| ▸ | WDR77 | Q9BQA1 | 7/20 | 0.41 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | STAT1 | P42224 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | CCR2 | P41597 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14112120 | 0.82 | HRH3 (0.59) | NPC1RAB9ASMN1; SMN2TP53HRH3 | |
| SCHEMBL14112142 | 0.78 | CYP2C9 (0.48) | NPC1RAB9ASMN1; SMN2TP53SLC18A3 | |
| SCHEMBL4071469 | 0.78 | TUBB4A (0.53) | NPC1RAB9ASMN1; SMN2TP53HRH3 | |
| SCHEMBL14112121 | 0.78 | MAPK8 (0.50) | NPC1RAB9ASMN1; SMN2TP53SLC18A3 | |
| SCHEMBL14112119 | 0.78 | NPC1 (0.55) | NPC1RAB9ASMN1; SMN2TP53HRH3 | |
| SCHEMBL14112140 | 0.78 | ALDH1A1 (0.58) | NPC1RAB9ASMN1; SMN2TP53SLC18A3 | |
| SCHEMBL1575388 | 0.75 | HRH3 (0.62) | HRH3CHRM4PDE4BCCR2 | |
| SCHEMBL14112113 | 0.75 | CCR2 (0.67) | CCR2 | |
| SCHEMBL14112130 | 0.75 | GRIN2B (0.65) | NPC1RAB9ASMN1; SMN2MAPTPDE4B | |
| SCHEMBL14112128 | 0.74 | EPHX2 (0.60) | MAPK8 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008060621-A2 | AMINOPYRROLIDINES AS CHEMOKINE RECEPTOR ANTAGONISTS | ABBOTT LABORATORIES (US) | 2008-05-22 | — | — | WO | disclosed |