Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 3/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | CCR9 | P51686 | 2/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 0.38 |
| ▸ | CTSS | P25774 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.36 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.36 |
| ▸ | NQO2 | P16083 | 1/20 | 0.36 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 4/20 | 0.35 |
| ▸ | XIAP | P98170 | 1/20 | 0.35 |
| ▸ | NSD2 | O96028 | 1/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30180715 | 1.00 | DRD2 (0.40) | DRD2DPP4CCR9DRD3CTSS | |
| SCHEMBL28580759 | 1.00 | DRD2 (0.40) | DRD2DPP4CCR9DRD3CTSS | |
| SCHEMBL28575235 | 0.92 | DRD2 (0.44) | DRD2DPP4CCR9DRD3CTSS | |
| SCHEMBL28575236 | 0.92 | DRD2 (0.44) | DRD2DPP4CCR9DRD3CTSS | |
| SCHEMBL28588251 | 0.88 | DRD2 (0.42) | DRD2DPP4DRD3CTSSCTSK | |
| SCHEMBL28588250 | 0.88 | DRD2 (0.42) | DRD2DPP4DRD3CTSSCTSK | |
| SCHEMBL21822134 | 0.86 | DRD2 (0.42) | DRD2DPP4CCR9DRD3CTSS | |
| SCHEMBL25017654 | 0.83 | DRD2 (0.40) | DRD2DPP4CCR9DRD3CNR1 | |
| SCHEMBL30180653 | 0.81 | DRD2 (0.42) | DRD2DPP4DRD3CTSSCTSK | |
| SCHEMBL28582675 | 0.81 | DRD2 (0.42) | DRD2DPP4DRD3CTSSCTSK |
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-112996529-A | Matriptase 2 inhibitor and application thereof | 迪斯克医药公司 | 2021-06-18 | — | — | CN | disclosed |