Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.56 |
| ▸ | DRD2 | P14416 | 6/20 | 0.46 |
| ▸ | KDM1A | O60341 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | CTSK | P43235 | 3/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3900948 | 1.00 | BTK (0.56) | BTKDRD2KDM1AMAOBKMT2A | |
| SCHEMBL6643451 | 1.00 | BTK (0.56) | BTKDRD2KDM1AMAOBKMT2A | |
| SCHEMBL6828924 | 0.91 | BTK (0.65) | BTKDRD2KDM1AMAOBKMT2A | |
| SCHEMBL6640171 | 0.91 | BTK (0.65) | BTKDRD2KDM1AMAOBKMT2A | |
| SCHEMBL6640571 | 0.91 | BTK (0.65) | BTKDRD2KDM1AMAOBKMT2A | |
| SCHEMBL6883712 | 0.91 | BTK (0.65) | BTKDRD2KDM1AMAOBKMT2A | |
| SCHEMBL6883716 | 0.91 | BTK (0.65) | BTKDRD2KDM1AMAOBKMT2A | |
| SCHEMBL622419 | 0.91 | BTK (0.51) | BTKDRD2KDM1AMAOBKMT2A | |
| SCHEMBL1543495 | 0.91 | BTK (0.51) | BTKDRD2KDM1AMAOBKMT2A | |
| SCHEMBL697088 | 0.91 | BTK (0.51) | BTKDRD2KDM1AMAOBKMT2A |
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-2015095301-A2 | CYTOTOXIC PEPTIDES AND CONJUGATES THEREOF | IRM LLC (BM) | 2015-06-25 | — | — | WO | disclosed |