Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.39 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10067712 | 0.89 | NPC1 (0.39) | NPC1RAB9AKDM4ESMN1; SMN2MEN1 | |
| SCHEMBL904096 | 0.85 | NPC1 (0.40) | NPC1RAB9AKDM4ESMN1; SMN2MEN1 | |
| SCHEMBL1008624 | 0.85 | GPR119 (0.47) | NPC1RAB9AKDM4EGPR119 | |
| SCHEMBL903953 | 0.79 | GPR119 (0.51) | GPR119 | |
| SCHEMBL903890 | 0.78 | SCN8A (0.40) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL1006626 | 0.78 | GPR119 (0.50) | GPR119 | |
| SCHEMBL1006128 | 0.77 | GPR119 (0.47) | NPC1RAB9AKDM4EGPR119 | |
| SCHEMBL904081 | 0.77 | KDM4E (0.42) | NPC1RAB9AKDM4ETSHRGPR119 | |
| SCHEMBL1004810 | 0.76 | GPR119 (0.48) | NPC1RAB9AKDM4EGPR119 | |
| SCHEMBL1003873 | 0.76 | SCN8A (0.44) | GPR119 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012041158-A1 | TRICYCLIC COMPOUND, PREPARATION METHOD AND PHARMACEUTICAL USE THEREOF | 上海恒瑞医药有限公司 (CN) | 2012-04-05 | — | — | WO | disclosed |