Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.35 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.35 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.35 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.35 |
| ▸ | STAT3 | P40763 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | TP53BP1 | Q12888 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9750619 | 0.92 | HDAC4 (0.38) | TP53STAT3HDAC4HDAC6 | |
| SCHEMBL9750593 | 0.80 | CFTR (0.40) | HDAC4HDAC6KDM4EALDH1A1 | |
| SCHEMBL9750700 | 0.80 | CNR2 (0.35) | TP53HDAC4 | |
| SCHEMBL9750532 | 0.76 | TP53 (0.31) | TP53 | |
| SCHEMBL9750623 | 0.74 | NPC1 (0.35) | TP53LMNAHTTNPSR1KDM4E | |
| SCHEMBL9750615 | 0.73 | KDM4E (0.41) | NPSR1HDAC4HDAC6KDM4EALDH1A1 | |
| SCHEMBL9750699 | 0.59 | KDM4E (0.40) | LMNANPSR1HDAC4HDAC6KDM4E | |
| SCHEMBL9750657 | 0.59 | KDM4E (0.43) | NPSR1HDAC4HDAC6KDM4EALDH1A1 | |
| SCHEMBL7975942 | 0.59 | EPHX2 (0.59) | TRPV1PDK2ALDH1A1 | |
| SCHEMBL11620317 | 0.58 | GAA (0.65) | LMNATSHRHTTSMN1; SMN2KDM4E |
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-5000775-A | 2-amino-4,5-disubstituted-oxazole/thiazole compounds as herbicide antidotes | MONSANTO COMPANY (US) | 1991-03-19 | — | — | US | disclosed |