Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.49 |
| ▸ | CYP11B1 | P15538 | 7/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 7/20 | 0.46 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | GPR119 | Q8TDV5 | 4/20 | 0.40 |
| ▸ | USP30 | Q70CQ3 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | HSD17B3 | P37058 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30900483 | 0.77 | NOTUM (0.61) | NPC1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL552069 | 0.77 | NOTUM (0.61) | NPC1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL3902752 | 0.76 | ESR2 (0.50) | BRD4CYP11B1CYP11B2GPR119USP30 | |
| SCHEMBL18666566 | 0.76 | DHODH (0.48) | BRD4CYP11B1CYP11B2GPR119USP30 | |
| SCHEMBL23063853 | 0.75 | HDAC1 (0.52) | BRD4CYP11B1CYP11B2GPR119USP30 | |
| SCHEMBL21056563 | 0.75 | CYP11B2 (0.53) | BRD4CYP11B1CYP11B2HSD17B3 | |
| SCHEMBL23063788 | 0.74 | BRD4 (0.49) | BRD4CYP11B1CYP11B2GPR119USP30 | |
| SCHEMBL20957007 | 0.74 | NOTUM (0.55) | BRD4CYP11B1CYP11B2CHRM4DRD2 | |
| SCHEMBL21056682 | 0.74 | CYP11B2 (0.55) | BRD4CYP11B1CYP11B2DHODH | |
| SCHEMBL20956971 | 0.74 | CYP11B2 (0.58) | BRD4CYP11B1CYP11B2MAPTSMN1; SMN2 |
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-2022096990-A1 | NOVEL HETROCYCLIC COMPOUNDS | CADILA HEALTHCARE LIMITED (IN) | 2022-05-12 | — | — | WO | disclosed |