Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 2/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL183353 | 0.80 | ALDH1A1 (0.52) | MAPTHTTLMNATSHRNLRP3 | |
| SCHEMBL10133349 | 0.75 | MMP3 (0.48) | MAPTHTTLMNATSHRNLRP3 | |
| SCHEMBL24205554 | 0.72 | SLC18A3 (0.50) | ALDH1A1 | |
| SCHEMBL377685 | 0.70 | CTSS (0.48) | EPHX1 | |
| SCHEMBL16480090 | 0.69 | CCR6 (0.47) | EPHX1CA1CA2ALDH1A1 | |
| Piperazine SCHEMBL27734165 | 0.69 | TYR (0.42) | EPHX1MAPTLMNAALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL23302911 | 0.69 | CTSS (0.47) | EPHX1 | |
| Hydrochloric Acid SCHEMBL383062 | 0.69 | CTSS (0.47) | EPHX1 | |
| SCHEMBL13450562 | 0.69 | CCR6 (0.47) | EPHX1CA1CA2ALDH1A1 | |
| SCHEMBL8799792 | 0.69 | HRH1 (0.54) | ALDH1A1 |
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 |