Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.39 |
| ▸ | CCR5 | P51681 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.38 |
| ▸ | SLC18A3 | Q16572 | 4/20 | 0.38 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.38 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28363730 | 0.84 | SLC18A3 (0.37) | SMN1; SMN2DRD2TSHROPRM1SLC18A3 | |
| SCHEMBL28367318 | 0.84 | PARP14 (0.43) | DRD2NPC1RAB9AOPRM1SLC18A3 | |
| SCHEMBL28363735 | 0.83 | HSD11B1 (0.44) | OPRM1SLC18A3 | |
| SCHEMBL28367567 | 0.81 | ALDH1A1 (0.39) | SMN1; SMN2NPC1TSHRRAB9ALMNA | |
| SCHEMBL16994794 | 0.74 | SLC18A3 (0.49) | SMN1; SMN2DRD2NPC1TP53TSHR | |
| SCHEMBL7465154 | 0.73 | CHRM1 (0.38) | TSHR | |
| SCHEMBL28367102 | 0.73 | CYP1A2 (0.40) | SMN1; SMN2NPC1TP53RAB9ALMNA | |
| SCHEMBL28367123 | 0.73 | KDM4E (0.41) | SMN1; SMN2TSHRKCNH2HRH3 | |
| SCHEMBL27885327 | 0.73 | ALDH1A1 (0.33) | SMN1; SMN2NPC1RAB9ANPSR1 | |
| SCHEMBL3710421 | 0.71 | SLC18A3 (0.52) | SMN1; SMN2DRD2TSHRSLC18A3CARM1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110878070-B | Method for preparing asymmetric urea compound | 中国科学院化学研究所 | 2021-08-31 | — | — | CN | disclosed |
| CN-110878070-A | Method for preparing asymmetric urea compound | 中国科学院化学研究所 | 2020-03-13 | — | — | CN | disclosed |