Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 5/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | GPR88 | Q9GZN0 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| Ethoxycarbonyl Group SCHEMBL29082342 | 0.86 | KMT2A (0.36) | SMN1; SMN2ALDH1A1MEN1KMT2ANPC1 | |
| Ethoxycarbonyl Group SCHEMBL27606185 | 0.86 | NPSR1 (0.38) | SMN1; SMN2ALDH1A1MEN1KMT2ARAB9A | |
| SCHEMBL9494 | 0.82 | RAB9A (0.47) | SMN1; SMN2ALDH1A1MEN1KMT2ARAB9A | |
| SCHEMBL29291074 | 0.80 | ALDH1A1 (0.39) | SMN1; SMN2ALDH1A1MEN1KMT2ARAB9A | |
| Ethoxycarbonyl Group SCHEMBL27868448 | 0.77 | NOTUM (0.62) | SMN1; SMN2ALDH1A1MEN1KMT2ARAB9A | |
| Ethoxycarbonyl Group SCHEMBL28920774 | 0.73 | GPR88 (0.39) | ALDH1A1MEN1KMT2ANOTUMPTGS2 | |
| Ethoxycarbonyl Group SCHEMBL28015510 | 0.72 | NOTUM (0.31) | NOTUM | |
| Ethoxycarbonyl Group SCHEMBL28264113 | 0.72 | KMT2A (0.36) | SMN1; SMN2ALDH1A1MEN1KMT2ARAB9A | |
| Ethylbenzene SCHEMBL27309269 | 0.71 | TP53 (0.58) | SMN1; SMN2ALDH1A1MEN1KMT2ARAB9A | |
| Ethoxycarbonyl Group SCHEMBL28300783 | 0.71 | TSHR (0.31) | TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-109071504-A | Inhibitors of receptor interacting protein kinase 1 | 戴纳立制药公司 | 2018-12-21 | — | — | CN | disclosed |