Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | F2 | P00734 | 2/20 | 0.45 |
| ▸ | F10 | P00742 | 2/20 | 0.45 |
| ▸ | FURIN | P09958 | 1/20 | 0.45 |
| ▸ | BTK | Q06187 | 1/20 | 0.45 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.42 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.42 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | FYN | P06241 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL18800606 | 0.90 | NQO2 (0.43) | SMN1; SMN2F2BTKPRSS1PRSS2 | |
| SCHEMBL18800610 | 0.88 | BTK (0.43) | F2F10FURINBTKPRSS1 | |
| SCHEMBL18800738 | 0.87 | TDO2 (0.49) | SMN1; SMN2PRSS1PRSS2PRSS3MAPT | |
| SCHEMBL18800557 | 0.86 | PRSS1 (0.45) | PRSS1PRSS2PRSS3MAPTCYP1A2 | |
| SCHEMBL18800739 | 0.81 | MEN1 (0.39) | F2F10BTKPRSS1PRSS2 | |
| SCHEMBL18800716 | 0.76 | PRKCQ (0.37) | SMN1; SMN2F2BTKPRSS1MAPT | |
| SCHEMBL18800769 | 0.76 | ADORA2A (0.48) | SMN1; SMN2BTKMAPTTSHRNPC1 | |
| SCHEMBL18800867 | 0.75 | BTK (0.50) | F10BTKPRSS1PRSS2PRSS3 | |
| SCHEMBL18800614 | 0.74 | ERBB2 (0.42) | CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL18780264 | 0.73 | BTK (0.55) | BTKPRSS1FYNKMT2AKDM4E |
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-2789615-B1 | Azaindazoles as Btk kinase modulators and use thereof | BRISTOL MYERS SQUIBB CO (US) | 2017-05-03 | — | — | EP | disclosed |