Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | AXL | P30530 | 2/20 | 0.43 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.40 |
| ▸ | CDK9 | P50750 | 1/20 | 0.40 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.39 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.35 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.35 |
| ▸ | CDK8 | P49336 | 2/20 | 0.35 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 4/20 | 0.34 |
| ▸ | PLG | P00747 | 1/20 | 0.34 |
| ▸ | PLAU | P00749 | 1/20 | 0.34 |
| ▸ | TNIK | Q9UKE5 | 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 | |
|---|---|---|---|---|
| SCHEMBL18250590 | 0.82 | MAP3K7 (0.44) | KMT2AAXLGSK3B | |
| SCHEMBL16945239 | 0.82 | MAP3K7 (0.44) | KMT2AAXLGSK3B | |
| SCHEMBL18238563 | 0.82 | MAP3K7 (0.44) | KMT2AAXLGSK3B | |
| SCHEMBL1337617 | 0.82 | KMT2A (0.51) | KMT2AAXLCCNT1CDK9HASPIN | |
| SCHEMBL22517081 | 0.82 | PRMT5 (0.42) | KMT2AAXLCDK8PTGER4GSK3B | |
| SCHEMBL8297635 | 0.82 | KMT2A (0.51) | KMT2AAXLCCNT1CDK9HASPIN | |
| SCHEMBL9906847 | 0.82 | KMT2A (0.51) | KMT2AAXLCCNT1CDK9HASPIN | |
| SCHEMBL18371565 | 0.82 | BTK (0.42) | KMT2AAXL | |
| SCHEMBL20319048 | 0.82 | MET (0.44) | KMT2AAXLPTGER4 | |
| SCHEMBL1563587 | 0.82 | KMT2A (0.51) | KMT2AAXLCCNT1CDK9HASPIN |
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-4104901-A1 | 3-SUBSTITUTED 1H-PYRROLO[2,3-B]PYRIDINE AS GRK5 MODULATORS | Lead Discovery Center GmbH (DE) | 2022-12-21 | — | — | EP | disclosed |