Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 7/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | LTA4H | P09960 | 5/20 | 0.44 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.41 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.39 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.39 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL1449935 | 0.99 | CCR5 (0.51) | CCR5LMNAKDM4ELTA4HS1PR5 | |
| SCHEMBL12742437 | 0.89 | CCR5 (0.49) | CCR5LMNALTA4HALDH1A1PTBP1 | |
| Hydrochloric Acid SCHEMBL1449291 | 0.88 | CCR5 (0.52) | CCR5LMNALTA4HALDH1A1PTBP1 | |
| Hydrochloric Acid SCHEMBL1448812 | 0.88 | CCR5 (0.52) | CCR5LMNALTA4HALDH1A1PTBP1 | |
| Hydrochloric Acid SCHEMBL1449259 | 0.88 | CCR5 (0.50) | CCR5LMNALTA4HALDH1A1PTBP1 | |
| Hydrochloric Acid SCHEMBL1448621 | 0.88 | CCR5 (0.53) | CCR5LTA4H | |
| Hydrochloric Acid SCHEMBL1449263 | 0.87 | CCR5 (0.51) | CCR5LMNALTA4HALDH1A1PTBP1 | |
| Hydrochloric Acid SCHEMBL1448935 | 0.87 | CCR5 (0.49) | CCR5LMNALTA4HS1PR5ALDH1A1 | |
| Hydrochloric Acid SCHEMBL1450158 | 0.87 | CCR5 (0.48) | CCR5LMNALTA4HS1PR5ALDH1A1 | |
| Hydrochloric Acid SCHEMBL1448735 | 0.87 | CCR5 (0.48) | CCR5LMNAKDM4ELTA4HS1PR5 |
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-2385040-A1 | Nitrogen-containing heterocyclic derivatives and drugs containing the same as the active ingredient | ONO Pharmaceutical Co., Ltd. (JP) | 2011-11-09 | — | — | EP | disclosed |
| US-7910741-B2 | Nitrogen-containing heterocyclic derivatives and drugs containing the same as the active ingredient | ONO PHARMACEUTICAL CO., LTD. (JP) | 2011-03-22 | — | — | US | disclosed |