Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 1/20 | 0.69 |
| ▸ | APEX1 | P27695 | 1/20 | 0.67 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.62 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.56 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | RAF1 | P04049 | 1/20 | 0.55 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
| ▸ | CA7 | P43166 | 1/20 | 0.54 |
| ▸ | CA9 | Q16790 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.54 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.54 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL11632558 | 0.90 | KDR (0.68) | KDRAPEX1PDK1TRPV1SLC6A3 | |
| SCHEMBL11201462 | 0.88 | APEX1 (0.67) | KDRAPEX1PDK1TRPV1TP53 | |
| SCHEMBL10222082 | 0.84 | KDR (0.59) | KDRAPEX1PDK1TRPV1SLC6A3 | |
| SCHEMBL10913149 | 0.83 | TP53 (0.57) | KDRAPEX1TRPV1TP53CA1 | |
| SCHEMBL462753 | 0.83 | KDR (0.76) | KDRPDK1TRPV1GRM4LMNA | |
| SCHEMBL16628095 | 0.83 | TRPV1 (0.65) | KDRPDK1TRPV1SLC6A3GRM4 | |
| SCHEMBL11092519 | 0.82 | RAF1 (0.59) | TP53LMNARAF1CA1CA2 | |
| SCHEMBL118026 | 0.82 | KDR (1.00) | KDRPDK1TRPV1GRM4CA1 | |
| SCHEMBL29364392 | 0.82 | KDR (1.00) | KDRPDK1TRPV1GRM4CA1 | |
| SCHEMBL848037 | 0.82 | MAPT (0.60) | APEX1TP53LMNARAF1MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4137068-A | Novel ureas | ROUSSEL UCLAF (FR) | 1979-01-30 | — | — | US | disclosed |
| US-3931311-A | N,N,N-trisubstituted N-halogenomethylurea and thiourea compounds and process for their preparation | BAYER AKTIENGESELLSCHAFT (DT) | 1976-01-06 | — | — | US | disclosed |