Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | PDE2A | O00408 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MAT2A | P31153 | 2/20 | 0.36 |
| ▸ | NCF1 | P14598 | 2/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29118669 | 0.98 | TDP1 (0.49) | L3MBTL1TDP1RAB9ANPY5RCYP1A2 | |
| SCHEMBL26534302 | 0.93 | CYP1A2 (0.40) | L3MBTL1TDP1RAB9ACYP1A2KDM4E | |
| SCHEMBL29118677 | 0.87 | NCF1 (0.42) | PDE2AKDM4ELMNANCF1 | |
| SCHEMBL28264907 | 0.78 | TDP1 (0.49) | L3MBTL1TDP1NPY5RCYP1A2KDM4E | |
| SCHEMBL30112542 | 0.76 | CTSK (0.40) | L3MBTL1TDP1RAB9AKDM4ELMNA | |
| SCHEMBL4237767 | 0.74 | TDP1 (0.46) | L3MBTL1TDP1CYP1A2KDM4ESMN1; SMN2 | |
| SCHEMBL637928 | 0.73 | CYP2A6 (0.50) | L3MBTL1CYP1A2KDM4ELMNANCF1 | |
| SCHEMBL25445038 | 0.72 | CTSS (0.40) | L3MBTL1TDP1NPY5RKDM4ELMNA | |
| SCHEMBL15046890 | 0.72 | HRH4 (0.40) | RAB9A | |
| SCHEMBL12490302 | 0.71 | ACHE (0.41) | L3MBTL1TDP1CYP1A2KDM4ENCF1 |
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-117186003-A | Preparation method of isoquinoline derivative | 苏州大学 | 2023-12-08 | — | — | CN | disclosed |