Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 4/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | MGLL | Q99685 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL28367123 | 0.86 | KDM4E (0.41) | CYP1A2CYP2C9CYP2C19AKR1C3SMN1; SMN2 | |
| SCHEMBL28363516 | 0.83 | SMN1; SMN2 (0.40) | AKR1C3SMN1; SMN2FKBP1AALDH1A1NPC1 | |
| SCHEMBL21402730 | 0.83 | SMN1; SMN2 (0.33) | TP53RAB9ASMN1; SMN2ALDH1A1NPC1 | |
| SCHEMBL5774548 | 0.83 | ALDH1A1 (0.43) | CYP2C9CYP2C19AKR1C3LMNARAB9A | |
| SCHEMBL28367071 | 0.80 | AKR1C3 (0.43) | AKR1C3LMNAALDH1A1POLB | |
| SCHEMBL28367567 | 0.79 | ALDH1A1 (0.39) | CYP1A2CYP2C9CYP2C19LMNARAB9A | |
| SCHEMBL28367073 | 0.77 | KMT2A (0.49) | LMNARAB9ASMN1; SMN2ALDH1A1FAAH | |
| SCHEMBL17385606 | 0.76 | PRKDC (0.39) | RAB9ASMN1; SMN2MAPK1L3MBTL1ALDH1A1 | |
| SCHEMBL28367014 | 0.73 | SMN1; SMN2 (0.41) | LMNATP53RAB9ASMN1; SMN2NPC1 | |
| SCHEMBL28363613 | 0.68 | ALDH1A1 (0.37) | CYP2C19RAB9AL3MBTL1ALDH1A1NPC1 |
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 |