Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.47 |
| ▸ | RAB9A | P51151 | 5/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.44 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CCR1 | P32246 | 1/20 | 0.41 |
| ▸ | CCR5 | P51681 | 1/20 | 0.41 |
| ▸ | CCR8 | P51685 | 1/20 | 0.41 |
| ▸ | METAP1 | P53582 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.41 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.41 |
| ▸ | MET | P08581 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30754191 | 0.83 | NPC1 (0.46) | NPC1RAB9ASMN1; SMN2ALDH1A1MCL1 | |
| SCHEMBL6888804 | 0.81 | LIMK2 (0.51) | NPC1RAB9ASMN1; SMN2ALDH1A1MCL1 | |
| Hydrochloric Acid SCHEMBL27589867 | 0.80 | LIMK2 (0.50) | NPC1RAB9ASMN1; SMN2ALDH1A1MCL1 | |
| SCHEMBL21313179 | 0.74 | ADORA2A (0.51) | NPC1RAB9ASMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL30888443 | 0.73 | KDM4E (0.43) | NPC1RAB9ASMN1; SMN2ALDH1A1MCL1 | |
| SCHEMBL30266730 | 0.73 | KDM4E (0.43) | NPC1RAB9ASMN1; SMN2ALDH1A1MCL1 | |
| SCHEMBL28320230 | 0.73 | KDM4E (0.43) | NPC1RAB9ASMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL16718698 | 0.73 | KDM4E (0.43) | NPC1RAB9ASMN1; SMN2ALDH1A1MCL1 | |
| SCHEMBL7114231 | 0.73 | KDM4E (0.43) | NPC1RAB9ASMN1; SMN2ALDH1A1MCL1 | |
| SCHEMBL1444936 | 0.73 | KDM4E (0.43) | NPC1RAB9ASMN1; SMN2ALDH1A1MCL1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110117281-A | Organic compound and electric driven color-changing part | 佳能株式会社 | 2019-08-13 | — | — | CN | disclosed |