Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 1/20 | 0.53 |
| ▸ | JAK1 | P23458 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.51 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.50 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CCR5 | P51681 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | GFER | P55789 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL18250748 | 0.84 | CCR5 (0.58) | OPRM1OPRD1OPRK1CYP2D6CCR5 | |
| SCHEMBL3448194 | 0.84 | GAA (0.61) | OPRM1OPRD1OPRK1CYP2D6CCR5 | |
| SCHEMBL7587030 | 0.82 | CCR5 (0.54) | JAK2JAK1OPRM1OPRD1OPRK1 | |
| SCHEMBL18250718 | 0.82 | GAA (0.64) | OPRM1OPRD1OPRK1CYP2D6CCR5 | |
| Hydrochloric Acid SCHEMBL4379304 | 0.81 | CCR5 (0.53) | JAK2JAK1OPRM1OPRD1OPRK1 | |
| SCHEMBL9673866 | 0.80 | CCR5 (0.60) | CYP2D6CCR5LMNAGAAALOX15 | |
| SCHEMBL14605232 | 0.79 | JAK1 (0.69) | JAK2JAK1GAAALOX15 | |
| SCHEMBL14605231 | 0.79 | JAK1 (0.69) | JAK2JAK1GAAALOX15 | |
| SCHEMBL13545208 | 0.77 | CCR5 (0.51) | OPRL1OPRM1OPRD1OPRK1CYP2D6 | |
| SCHEMBL739512 | 0.76 | HDAC1 (0.49) | HDAC1HDAC8HDAC6OPRL1OPRM1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | disclosed |
| US-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | disclosed |