Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 3/20 | 0.42 |
| ▸ | HTR2A | P28223 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | MET | P08581 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.34 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.34 |
| ▸ | PARK7 | Q99497 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18544278 | 0.83 | HTR2C (0.37) | HTR2CHTR2AALDH1A1KDM4EKMT2A | |
| SCHEMBL21321498 | 0.79 | HTR2C (0.35) | HTR2CHTR2AALDH1A1KDM4ETSHR | |
| SCHEMBL14578011 | 0.76 | HTR2C (0.47) | HTR2CHTR2AHTR7CDC7CDK2 | |
| SCHEMBL14320197 | 0.76 | BTK (0.46) | HTR2CHTR2AKDM4EHDAC1HDAC6 | |
| SCHEMBL28779597 | 0.73 | HDAC1 (0.43) | HTR2CHTR2AALDH1A1KDM4EHTR7 | |
| SCHEMBL3263915 | 0.73 | BRPF1 (0.57) | HTR2CHTR2AALDH1A1KDM4EMEN1 | |
| SCHEMBL29520718 | 0.72 | HTR2C (0.49) | HTR2CHTR2A | |
| SCHEMBL3214955 | 0.70 | KAT2B (0.43) | ALDH1A1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL17637279 | 0.70 | HDAC1 (0.45) | HTR2CHTR2AHDAC1HDAC6PARK7 | |
| SCHEMBL30448661 | 0.70 | HDAC1 (0.43) | HTR2CHTR2AALDH1A1KDM4EHDAC1 |
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-2017029602-A2 | COMPOUNDS FOR USE IN ANTIBACTERIAL APPLICATIONS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2017-02-23 | — | — | WO | disclosed |