Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 3/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.60 |
| ▸ | ATM | Q13315 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.52 |
| ▸ | NPC1 | O15118 | 7/20 | 0.46 |
| ▸ | RAB9A | P51151 | 7/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | RECQL | P46063 | 2/20 | 0.42 |
| ▸ | FABP3 | P05413 | 1/20 | 0.41 |
| ▸ | FABP4 | P15090 | 1/20 | 0.41 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 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 | |
|---|---|---|---|---|
| SCHEMBL20274643 | 0.84 | POLB (0.56) | POLBKDM4EATMCYP2C19NPC1 | |
| SCHEMBL28392229 | 0.83 | POLB (0.67) | POLBKDM4EATMCYP2C19NPC1 | |
| SCHEMBL848499 | 0.83 | POLB (0.64) | POLBKDM4EATMCYP2C19SMN1; SMN2 | |
| SCHEMBL31087257 | 0.83 | POLB (0.64) | POLBKDM4EATMCYP2C19SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL15974089 | 0.81 | POLB (0.62) | POLBKDM4EATMCYP2C19SMN1; SMN2 | |
| SCHEMBL8628627 | 0.80 | POLB (0.67) | POLBKDM4EATMCYP2C19SMN1; SMN2 | |
| Benzil SCHEMBL19279005 | 0.80 | POLB (0.56) | POLBKDM4EATMCYP2C19NPC1 | |
| SCHEMBL8025292 | 0.80 | POLB (0.56) | POLBKDM4EATMCYP2C19NPC1 | |
| SCHEMBL1318394 | 0.80 | KDM4E (0.61) | POLBKDM4EATMCYP2C19NPC1 | |
| SCHEMBL6964053 | 0.78 | KDM4E (0.64) | POLBKDM4EATMCYP2C19NPC1 |
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-101321529-A | Diaryl aether derivant as antineoplastic agent | OTSUKA PHARMA CO LTD (JP) | 2008-12-10 | — | — | CN | disclosed |