Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | AURKB | Q96GD4 | 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 | |
|---|---|---|---|---|
| SCHEMBL15661917 | 0.86 | KDM4E (0.42) | KDM4EALDH1A1HPGDNPSR1SMN1; SMN2 | |
| SCHEMBL15660258 | 0.86 | KDM4E (0.45) | KDM4EALDH1A1HPGDNPSR1SMN1; SMN2 | |
| SCHEMBL12659574 | 0.83 | KDM4E (0.57) | KDM4EALDH1A1HPGDNPSR1SMN1; SMN2 | |
| SCHEMBL1646652 | 0.79 | TP53 (0.44) | KDM4EALDH1A1HPGDNPSR1SMN1; SMN2 | |
| SCHEMBL15660254 | 0.79 | KDM4E (0.49) | KDM4EALDH1A1HPGDNPSR1SMN1; SMN2 | |
| SCHEMBL1646700 | 0.78 | AURKA (0.59) | KDM4EALDH1A1HPGDNPSR1SMN1; SMN2 | |
| SCHEMBL1645085 | 0.77 | HPSE (0.45) | KDM4EALDH1A1HPGDNPSR1SMN1; SMN2 | |
| SCHEMBL1646052 | 0.74 | CDK1 (0.61) | KDM4EALDH1A1HPGDNPSR1SMN1; SMN2 | |
| SCHEMBL8305733 | 0.74 | ALDH1A1 (0.46) | KDM4EALDH1A1HPGDNPSR1SMN1; SMN2 | |
| SCHEMBL1645956 | 0.73 | ALDH1A1 (0.59) | KDM4EALDH1A1HPGDSMN1; SMN2MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9988378-B2 | 1 H-pyrazole and 4,5-disubstituted thiazole inhibitors of SYK | HOFFMANN-LA ROCHE INC. (CH) | 2018-06-05 | — | — | US | disclosed |