Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.50 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | TACR1 | P25103 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.41 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.41 |
| ▸ | CHRNG | P07510 | 1/20 | 0.41 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL23647440 | 1.00 | KDM1A (0.50) | KDM1AADRB1HTR2CKMT2ATACR1 | |
| SCHEMBL23017691 | 0.91 | KDM1A (0.48) | KDM1AADRB1HTR2CKMT2ATACR1 | |
| SCHEMBL3159689 | 0.88 | KDM1A (0.57) | KDM1AKMT2ASLC6A4ALDH1A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL18742400 | 0.86 | KDM1A (0.56) | KDM1AKMT2ASLC6A4ALDH1A1CYP3A4 | |
| SCHEMBL17982834 | 0.85 | KDM1A (0.54) | KDM1ASLC6A4SLC6A2SLC6A3 | |
| SCHEMBL521519 | 0.85 | KDM1A (0.54) | KDM1AKMT2ASLC6A4SLC6A2SLC6A3 | |
| Hydrochloric Acid SCHEMBL18742809 | 0.83 | KDM1A (0.53) | KDM1ASLC6A4SLC6A2SLC6A3 | |
| SCHEMBL5221231 | 0.83 | KDM1A (0.53) | KDM1A | |
| SCHEMBL28001878 | 0.82 | ADRB1 (0.49) | KDM1AADRB1HTR2CKMT2ATACR1 | |
| SCHEMBL737743 | 0.81 | OPRM1 (0.57) | KDM1AADRB1HTR2CKMT2AALDH1A1 |
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-114867720-B | Heteroaryl derivatives, preparation method and application thereof | 浙江海正药业股份有限公司 | 2024-10-22 | — | — | CN | disclosed |