Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | MAOA | P21397 | 1/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | PPARG | P37231 | 1/20 | 0.48 |
| ▸ | PPARA | Q07869 | 1/20 | 0.48 |
| ▸ | CASP3 | P42574 | 1/20 | 0.48 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.48 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.48 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL16024669 | 1.00 | HTR2A (0.53) | HTR2APTGS2CYP1A2KDM4ENPC1 | |
| SCHEMBL16024605 | 1.00 | HTR2A (0.53) | HTR2APTGS2CYP1A2KDM4ENPC1 | |
| SCHEMBL19506648 | 0.97 | HTR2A (0.56) | HTR2APTGS2CYP1A2KDM4ENPC1 | |
| SCHEMBL16024600 | 0.97 | HTR2A (0.56) | HTR2APTGS2CYP1A2KDM4ENPC1 | |
| SCHEMBL14783441 | 0.97 | HTR2A (0.56) | HTR2APTGS2CYP1A2KDM4ENPC1 | |
| SCHEMBL7061128 | 0.95 | PTGS2 (0.57) | HTR2APTGS2CYP1A2KDM4ENPC1 | |
| SCHEMBL28131897 | 0.93 | CYP1A2 (0.55) | HTR2APTGS2CYP1A2KDM4ENPC1 | |
| SCHEMBL11246667 | 0.90 | CYP1A2 (0.58) | HTR2APTGS2CYP1A2KDM4ENPC1 | |
| SCHEMBL18556121 | 0.86 | PTGS2 (0.55) | HTR2APTGS2KDM4ELMNATP53 | |
| SCHEMBL27519533 | 0.86 | PTGS2 (0.55) | HTR2APTGS2KDM4ELMNATP53 |
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-104650110-B | Novel heterocyclic compound, method for producing intermediate therefor, and use thereof | 日本化药株式会社 | 2017-04-12 | — | — | CN | disclosed |