Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.52 |
| ▸ | SLC2A1 | P11166 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | CCR3 | P51677 | 6/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | CCR5 | P51681 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL6056742 | 0.96 | CCR3 (0.57) | OPRM1SLC2A1MEN1GAAHTT | |
| Trifluoroacetic Acid SCHEMBL6056715 | 0.95 | SLC2A1 (0.51) | OPRM1SLC2A1MEN1GAAHTT | |
| Trifluoroacetic Acid SCHEMBL6056780 | 0.95 | SLC2A1 (0.49) | OPRM1SLC2A1MEN1GAAHTT | |
| Trifluoroacetic Acid SCHEMBL6056787 | 0.93 | OPRM1 (0.53) | OPRM1SLC2A1MEN1GAAHTT | |
| Trifluoroacetic Acid SCHEMBL6056748 | 0.92 | MEN1 (0.50) | OPRM1SLC2A1MEN1GAAHTT | |
| Trifluoroacetic Acid SCHEMBL6056717 | 0.92 | SLC6A2 (0.48) | OPRM1SLC2A1MEN1GAAHTT | |
| Trifluoroacetic Acid SCHEMBL6056728 | 0.92 | ALDH1A1 (0.47) | OPRM1SLC2A1MEN1GAAHTT | |
| Trifluoroacetic Acid SCHEMBL6056644 | 0.92 | CCR3 (0.48) | OPRM1SLC2A1MEN1GAAHTT | |
| Trifluoroacetic Acid SCHEMBL6056754 | 0.91 | SLC2A1 (0.48) | OPRM1SLC2A1MEN1GAAHTT | |
| Trifluoroacetic Acid SCHEMBL6056753 | 0.91 | MEN1 (0.46) | OPRM1SLC2A1MEN1GAAHTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1219605-B1 | UREA COMPOUNDS, PROCESS FOR PRODUCING THE SAME AND USE THEREOF | TAKEDA PHARMACEUTICAL (JP) | 2006-05-10 | — | — | EP | disclosed |
| US-6787650-B1 | CCR5 ANTAGONISTIC ACTIVITY; SUCH AS N-(3-(4-BENZYL-1-PIPERIDINYL)PROPYL)-N'-4-CHLOROPHENYL)-N-PHENYLUREA | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2004-09-07 | — | — | US | disclosed |
| EP-1219605-A1 | UREA COMPOUNDS, PROCESS FOR PRODUCING THE SAME AND USE THEREOF | Takeda Chemical Industries, Ltd. (JP) | 2002-07-03 | — | — | EP | disclosed |