Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CCR5 | P51681 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 2/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4551165 | 0.93 | SIGMAR1 (0.40) | KMT2ASIGMAR1MCHR1CCR5CHRM3 | |
| SCHEMBL4396457 | 0.92 | HRH3 (0.42) | KMT2AKCNH2KDM4EFAAH | |
| SCHEMBL4410349 | 0.92 | HRH3 (0.42) | KMT2AKCNH2KDM4EFAAH | |
| SCHEMBL4396410 | 0.91 | L3MBTL1 (0.40) | MCHR1DYRK1AKDM4EFAAH | |
| SCHEMBL4396337 | 0.90 | HTR7 (0.43) | KMT2AMEN1KDM4EFAAH | |
| SCHEMBL4405570 | 0.90 | TLR7 (0.43) | KMT2ASIGMAR1HTR4DYRK1AKDM4E | |
| SCHEMBL4405673 | 0.89 | CHRM3 (0.42) | MCHR1CHRM3DRD4KCNH2DYRK1A | |
| SCHEMBL4406646 | 0.89 | TSHR (0.42) | KMT2ASIGMAR1MCHR1MEN1HTR4 | |
| SCHEMBL4394199 | 0.89 | CHRM3 (0.41) | CHRM3HTR4DYRK1AFAAHACKR3 | |
| SCHEMBL4396957 | 0.89 | TLR9 (0.42) | SIGMAR1HTR4DYRK1AACKR3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1720859-B1 | CHEMOKINE RECEPTOR ANTAGONISTS | NOVARTIS AG (CH) | 2009-12-23 | — | — | EP | claimed |