Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 9/20 | 1.00 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.62 |
| ▸ | CRHBP | P24387 | 1/20 | 0.61 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.61 |
| ▸ | HPGD | P15428 | 6/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.55 |
| ▸ | LMNA | P02545 | 4/20 | 0.55 |
| ▸ | NPC1 | O15118 | 4/20 | 0.55 |
| ▸ | MEN1 | O00255 | 4/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.55 |
| ▸ | RAB9A | P51151 | 3/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | KIF11 | P52732 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL14820276 | 0.80 | KDM4E (0.66) | KDM4EALDH1A1CRHBPCRHR2HPGD | |
| SCHEMBL29976744 | 0.77 | KDM4E (1.00) | KDM4EALDH1A1CRHBPCRHR2HPGD | |
| SCHEMBL9179305 | 0.77 | KDM4E (1.00) | KDM4EALDH1A1CRHBPCRHR2HPGD | |
| SCHEMBL14805753 | 0.77 | KDM4E (0.62) | KDM4EALDH1A1CRHBPCRHR2HPGD | |
| SCHEMBL4791757 | 0.77 | ALDH1A1 (1.00) | KDM4EALDH1A1HPGDSMN1; SMN2LMNA | |
| SCHEMBL30374884 | 0.77 | ALDH1A1 (1.00) | KDM4EALDH1A1HPGDSMN1; SMN2LMNA | |
| SCHEMBL21959783 | 0.75 | KDM4E (0.60) | KDM4EALDH1A1HPGDSMN1; SMN2NPC1 | |
| SCHEMBL2722372 | 0.75 | KDM4E (0.59) | KDM4EALDH1A1CRHBPCRHR2HPGD | |
| SCHEMBL9377702 | 0.74 | ALDH1A1 (0.68) | KDM4EALDH1A1HPGDSMN1; SMN2LMNA | |
| SCHEMBL1173328 | 0.73 | AR (0.67) | KDM4E |
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-5112837-A | Inhibitors of thymidylate synthetase enzyme | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-05-12 | — | — | US | disclosed |