Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.35 |
| ▸ | ESRRB | O95718 | 2/20 | 0.35 |
| ▸ | ESRRG | P62508 | 2/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.35 |
| ▸ | CDK4 | P11802 | 4/20 | 0.35 |
| ▸ | CCND1 | P24385 | 4/20 | 0.35 |
| ▸ | CDK2 | P24941 | 4/20 | 0.35 |
| ▸ | IGF1R | P08069 | 3/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | CCR5 | P51681 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 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 | |
|---|---|---|---|---|
| SCHEMBL17897288 | 0.84 | SLC6A9 (0.43) | KDM4EADRA2AADRA2BADRA2C | |
| SCHEMBL15858970 | 0.84 | MAPT (0.43) | KDM4EALDH1A1MAPT | |
| SCHEMBL17897235 | 0.84 | MAPT (0.43) | KDM4EALDH1A1MAPT | |
| SCHEMBL19003591 | 0.84 | SLC6A9 (0.43) | KDM4EADRA2AADRA2BADRA2C | |
| SCHEMBL17897247 | 0.83 | KDM4E (0.41) | KDM4EALDH1A1ADRA2AADRA2BADRA2C | |
| SCHEMBL19003675 | 0.83 | KDM4E (0.41) | KDM4EALDH1A1ADRA2AADRA2BADRA2C | |
| SCHEMBL17897242 | 0.83 | KDM4E (0.41) | KDM4EALDH1A1ADRA2AADRA2BADRA2C | |
| SCHEMBL31276581 | 0.78 | ADRA2A (0.44) | HRH3ADRA2AADRA2BADRA2C | |
| SCHEMBL29964416 | 0.78 | ADRA2A (0.44) | HRH3ADRA2AADRA2BADRA2C | |
| SCHEMBL29964267 | 0.75 | HRH3 (0.40) | MAPTAKR1C3HRH3CDK4CCND1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022226667-A1 | SUBSTITUTED AMINO PYRIDINE COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) | ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) | 2022-11-03 | — | — | WO | disclosed |
| WO-2022226668-A1 | HALO-SUBSTITUTED AMINO PYRIDINE COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) | ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) | 2022-11-03 | — | — | WO | disclosed |