Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXFP1 | Q9HBX9 | 9/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | PLK1 | P53350 | 1/20 | 0.44 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 7/20 | 0.42 |
| ▸ | NR2E3 | Q9Y5X4 | 7/20 | 0.42 |
| ▸ | NCOR2 | Q9Y618 | 7/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29446409 | 0.81 | RXFP1 (0.61) | RXFP1ALDH1A1HTTTSHRHSD17B10 | |
| SCHEMBL26851460 | 0.75 | PLK1 (0.70) | PLK1 | |
| SCHEMBL26851506 | 0.69 | PLK1 (0.62) | PLK1 | |
| SCHEMBL29446426 | 0.66 | ALDH1A1 (0.52) | ALDH1A1TSHRLMNASMN1; SMN2KDM4E | |
| SCHEMBL29446422 | 0.63 | ALDH1A1 (0.51) | ALDH1A1ADORA2BLMNASMN1; SMN2KDM4E | |
| SCHEMBL26851462 | 0.62 | PLK1 (0.68) | PLK1 | |
| SCHEMBL29446398 | 0.62 | NPC1 (0.52) | RXFP1ALDH1A1PLK1NPSR1SMN1; SMN2 | |
| SCHEMBL29446432 | 0.62 | ALDH1A1 (0.73) | RXFP1ALDH1A1KDM4EMAPTKMT2A | |
| SCHEMBL7889976 | 0.62 | ALDH1A1 (0.64) | ALDH1A1HSD17B10LMNASMN1; SMN2KDM4E | |
| SCHEMBL24324406 | 0.61 | PLK1 (1.00) | PLK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4216958-A2 | PLK1 POLO BOX DOMAIN INHIBITORS AND METHOD OF TREATING CANCER | The United States of America, as represented by the Secretary, Department of Health and Human Services (US) | 2023-08-02 | — | — | EP | disclosed |
| WO-2022067100-A2 | PLK1 POLO BOX DOMAIN INHIBITOR AND METHOD OF TREATING CANCER | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2022-03-31 | — | — | WO | disclosed |