Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSIP1 | O75475 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | TNF | P01375 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 2/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.37 |
| ▸ | FLT1 | P17948 | 1/20 | 0.37 |
| ▸ | FLT4 | P35916 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.36 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10066425 | 0.86 | PSIP1 (0.56) | PSIP1NPC1TNFRAB9ANOD1 | |
| SCHEMBL28281645 | 0.85 | PSIP1 (0.50) | PSIP1NPC1TNFRAB9ANOD1 | |
| SCHEMBL17263850 | 0.83 | PSIP1 (0.68) | PSIP1NPC1RAB9ABRD4GAA | |
| SCHEMBL2642741 | 0.82 | PSIP1 (0.66) | PSIP1NPC1TNFRAB9ANOD1 | |
| SCHEMBL10180981 | 0.82 | PSIP1 (0.52) | PSIP1NPC1TNFRAB9ANOD1 | |
| SCHEMBL23214313 | 0.82 | PSIP1 (0.52) | PSIP1NPC1TNFRAB9ANOD1 | |
| SCHEMBL19277486 | 0.82 | PSIP1 (0.52) | PSIP1NPC1TNFRAB9ANOD1 | |
| SCHEMBL2642739 | 0.82 | PSIP1 (0.52) | PSIP1NPC1TNFRAB9ANOD1 | |
| SCHEMBL31192532 | 0.82 | PSIP1 (0.52) | PSIP1NPC1TNFRAB9ANOD1 | |
| SCHEMBL7054313 | 0.82 | ALDH1A1 (0.47) | NPC1TNFRAB9ANOD1HTR6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109071509-A | BENZIMIDAZOLE DERIVATIVES AS MODULATORS OF ROR-GAMMA | 生命医药公司 | 2018-12-21 | — | — | CN | disclosed |