Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 6/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 6/20 | 0.43 |
| ▸ | TNF | P01375 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.38 |
| ▸ | LPL | P06858 | 1/20 | 0.37 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL30270036 | 1.00 | CYP11B1 (0.43) | CYP11B1CYP11B2TNFBRD4ALDH1A1 | |
| SCHEMBL15333687 | 0.86 | CYP11B1 (0.52) | CYP11B1CYP11B2TNFBRD4ALDH1A1 | |
| SCHEMBL15205399 | 0.80 | CYP11B1 (0.52) | CYP11B1CYP11B2TNFALDH1A1ERBB2 | |
| SCHEMBL30270089 | 0.80 | CYP11B1 (0.52) | CYP11B1CYP11B2TNFBRD4ALDH1A1 | |
| SCHEMBL3497335 | 0.79 | CYP11B1 (0.60) | CYP11B1CYP11B2TNFALDH1A1SMN1; SMN2 | |
| SCHEMBL15205440 | 0.76 | CDK9 (0.40) | CYP11B1CYP11B2TNFBRD4ALDH1A1 | |
| SCHEMBL15206133 | 0.76 | CDK9 (0.43) | CYP11B1CYP11B2TNFBRD4ALDH1A1 | |
| SCHEMBL20644622 | 0.72 | KDM4E (0.47) | ALDH1A1DRD2SMN1; SMN2 | |
| SCHEMBL15288424 | 0.71 | LPL (0.41) | ALDH1A1SMN1; SMN2LPLLIPGMEN1 | |
| SCHEMBL17674116 | 0.70 | TGFBR1 (0.39) | ALDH1A1DRD2DRD4DRD3SMN1; 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 |
|---|---|---|---|---|---|---|---|
| CN-108779094-B | Metalloenzyme inhibitor compounds | NQP 1598公司 | 2021-11-16 | — | — | CN | disclosed |