Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | TACR1 | P25103 | 2/20 | 0.42 |
| ▸ | HTR2C | P28335 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL28024313 | 0.88 | HIF1A (0.42) | MMP13HIF1ATACR1HTR2CCA1 | |
| SCHEMBL16950303 | 0.86 | HIF1A (0.41) | MMP13HIF1AHTR2CCA1CA2 | |
| SCHEMBL24758006 | 0.86 | HIF1A (0.41) | HIF1AHTR2CCYP2D6CA1CA2 | |
| SCHEMBL15577039 | 0.86 | HIF1A (0.42) | MMP13HIF1AHDAC4HDAC8ALDH1A1 | |
| SCHEMBL27016299 | 0.86 | HDAC4 (0.46) | HIF1AHDAC4HDAC8ALDH1A1HTR2C | |
| SCHEMBL25467236 | 0.80 | PDE2A (0.38) | MMP13ALDH1A1TACR1 | |
| SCHEMBL16957130 | 0.80 | HTR2C (0.37) | MMP13HIF1AALDH1A1HTR2C | |
| SCHEMBL21495050 | 0.78 | MMP13 (0.36) | MMP13HIF1AALDH1A1HTR2CCA1 | |
| SCHEMBL16950664 | 0.78 | PPARG (0.41) | HIF1AHTR2CSMN1; SMN2CA1CA2 | |
| SCHEMBL6707301 | 0.76 | HTR2C (0.58) | HDAC4HDAC8HTR2C |
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-2019118358-A1 | HEPATITIS B CAPSID ASSEMBLY MODULATORS | VenatoRx Pharmaceuticals, Inc. (US) | 2019-06-20 | — | — | WO | disclosed |