Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 3/20 | 0.44 |
| ▸ | MME | P08473 | 5/20 | 0.38 |
| ▸ | GGT1 | P19440 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4620943 | 1.00 | TGFBR1 (0.44) | TGFBR1MMEGGT1ADRA1ATDP1 | |
| SCHEMBL4619523 | 1.00 | TGFBR1 (0.44) | TGFBR1MMEGGT1ADRA1ATDP1 | |
| SCHEMBL693298 | 0.87 | NOD1 (0.46) | TGFBR1CA2NOD1KDM4EALOX15 | |
| SCHEMBL693299 | 0.87 | NOD1 (0.46) | TGFBR1CA2NOD1KDM4EALOX15 | |
| SCHEMBL27557225 | 0.87 | NOD1 (0.46) | TGFBR1CA2NOD1KDM4EALOX15 | |
| SCHEMBL2282988 | 0.85 | NOD1 (0.48) | TGFBR1NOD1KDM4ESMN1; SMN2 | |
| SCHEMBL2282993 | 0.85 | NOD1 (0.48) | TGFBR1NOD1KDM4ESMN1; SMN2 | |
| SCHEMBL23948850 | 0.84 | GGT1 (0.37) | GGT1ADRA1ATDP1CHRM1AKR1A1 | |
| SCHEMBL17319734 | 0.84 | GGT1 (0.37) | GGT1ADRA1ATDP1CHRM1AKR1A1 | |
| SCHEMBL15580316 | 0.84 | GGT1 (0.37) | GGT1ADRA1ATDP1CHRM1AKR1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111909108-B | Biphenyl compound and preparation method and medical application thereof | 中国药科大学 | 2023-05-02 | — | — | CN | disclosed |
| CN-110128415-B | Indoline compound used as immunomodulator and preparation method thereof | 沈阳药科大学 | 2022-03-25 | — | — | CN | disclosed |
| EP-1884230-A1 | PARAKERATOSIS INHIBITOR, PORE-SHRINKING AGENT OR AGENT FOR PREVENTING/AMELIORATING ROUGH SKIN AND EXTERNAL COMPOSITION FOR SKIN | Shiseido Company, Limited (JP) | 2008-02-06 | — | — | EP | disclosed |