Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.33 |
| ▸ | CENPE | Q02224 | 7/20 | 0.33 |
| ▸ | TACR2 | P21452 | 1/20 | 0.33 |
| ▸ | TACR1 | P25103 | 1/20 | 0.33 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.32 |
| ▸ | ESRRG | P62508 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | ESRRB | O95718 | 1/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.32 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
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 SCHEMBL748806 | 0.99 | TP53 (0.33) | TP53MAPTOPRM1OPRD1CENPE | |
| SCHEMBL745512 | 0.92 | OPRM1 (0.34) | TP53MAPTOPRM1OPRD1TACR2 | |
| SCHEMBL746654 | 0.91 | OPRM1 (0.34) | TP53MAPTOPRM1OPRD1TACR2 | |
| Hydrochloric Acid SCHEMBL747110 | 0.91 | OPRM1 (0.34) | TP53MAPTOPRM1OPRD1TACR2 | |
| SCHEMBL747946 | 0.91 | TP53 (0.40) | TP53MAPTESRRG | |
| Hydrochloric Acid SCHEMBL751441 | 0.90 | OPRM1 (0.33) | TP53MAPTOPRM1OPRD1TACR2 | |
| SCHEMBL751012 | 0.88 | PARP1 (0.36) | TP53MAPTOPRM1OPRD1NR1H4 | |
| SCHEMBL745501 | 0.88 | TMEM97 (0.39) | TP53OPRM1OPRD1NR1H4SIGMAR1 | |
| SCHEMBL747122 | 0.88 | TP53 (0.33) | TP53MAPTOPRM1OPRD1NR1H4 | |
| Hydrochloric Acid SCHEMBL747648 | 0.88 | PARP1 (0.36) | TP53MAPTOPRM1OPRD1NR1H4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2049493-B1 | COMPOUNDS SUITABLE AS MODULATORS OF HDL | CADILA HEALTHCARE LTD (IN) | 2012-03-21 | — | — | EP | claimed |
| US-8022217-B2 | Compounds suitable as modulators of HDL | CADILA HEALTHCARE LIMITED (IN) | 2011-09-20 | — | — | US | claimed |
| EP-2049493-B1 | COMPOUNDS SUITABLE AS MODULATORS OF HDL | CADILA HEALTHCARE LTD (IN) | 2012-03-21 | — | — | EP | disclosed |
| US-8022217-B2 | Compounds suitable as modulators of HDL | CADILA HEALTHCARE LIMITED (IN) | 2011-09-20 | — | — | US | disclosed |