Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 7/20 | 0.36 |
| ▸ | NOS2 | P35228 | 7/20 | 0.36 |
| ▸ | NOS3 | P29474 | 4/20 | 0.36 |
| ▸ | LNPEP | Q9UIQ6 | 4/20 | 0.35 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CRHBP | P24387 | 1/20 | 0.32 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.32 |
| ▸ | KIF11 | P52732 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28292630 | 0.87 | MEN1 (0.48) | MEN1KMT2AKDM4ELMNACYP3A4 | |
| SCHEMBL15880806 | 0.82 | CYP1A2 (0.50) | MEN1KMT2AKDM4ELMNACYP3A4 | |
| SCHEMBL29064128 | 0.78 | NOS2 (0.62) | MEN1KMT2AKDM4ELMNANOS1 | |
| SCHEMBL28292551 | 0.77 | LNPEP (0.46) | MEN1KMT2ALNPEP | |
| SCHEMBL28940950 | 0.76 | KMT2A (0.44) | MEN1KMT2AALDH1A1KIF11 | |
| SCHEMBL4104275 | 0.76 | NOS2 (0.59) | KDM4ENOS1NOS2NOS3CYP2C9 | |
| SCHEMBL18641430 | 0.76 | KMT2A (0.52) | MEN1KMT2AKDM4ELMNACYP3A4 | |
| SCHEMBL28292626 | 0.75 | KMT2A (0.39) | MEN1KMT2APARP10MAPTKIF11 | |
| SCHEMBL14012773 | 0.75 | NOS1 (0.41) | KMT2AKDM4ELMNACYP3A4TSHR | |
| SCHEMBL5147899 | 0.75 | TSHR (0.51) | MEN1KMT2AKDM4ELMNACYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109689647-B | Bicyclic heteroaryl substituted compounds | 百时美施贵宝公司 | 2023-01-20 | — | — | CN | claimed |
| CN-109689647-B | Bicyclic heteroaryl substituted compounds | 百时美施贵宝公司 | 2023-01-20 | — | — | CN | disclosed |
| CN-109689647-A | The compound that bicyclic heteroaryl replaces | 百时美施贵宝公司 | 2019-04-26 | — | — | CN | disclosed |