Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 3/20 | 0.35 |
| ▸ | IL6ST | P40189 | 1/20 | 0.35 |
| ▸ | AVPR1A | P37288 | 5/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | NAAA | Q02083 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.31 |
| ▸ | IDH1 | O75874 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21930008 | 1.00 | RIPK1 (0.39) | RIPK1ALDH1A1GAAHTTUSP2 | |
| SCHEMBL21930010 | 1.00 | RIPK1 (0.39) | RIPK1ALDH1A1GAAHTTUSP2 | |
| SCHEMBL21930236 | 0.88 | ALDH1A1 (0.39) | RIPK1ALDH1A1GAAHTTIL6ST | |
| SCHEMBL21930233 | 0.88 | ALDH1A1 (0.39) | RIPK1ALDH1A1GAAHTTIL6ST | |
| SCHEMBL21930237 | 0.88 | ALDH1A1 (0.39) | RIPK1ALDH1A1GAAHTTIL6ST | |
| SCHEMBL3113303 | 0.86 | ALDH1A1 (0.38) | RIPK1ALDH1A1GAAHTTIL6ST | |
| SCHEMBL14089355 | 0.86 | ALDH1A1 (0.38) | RIPK1ALDH1A1GAAHTTIL6ST | |
| SCHEMBL21930033 | 0.84 | ALDH1A1 (0.38) | RIPK1ALDH1A1GAAHTTIL6ST | |
| SCHEMBL21930035 | 0.84 | ALDH1A1 (0.38) | RIPK1ALDH1A1GAAHTTIL6ST | |
| SCHEMBL21930030 | 0.84 | ALDH1A1 (0.38) | RIPK1ALDH1A1GAAHTTIL6ST |
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-113166173-A | Spiro-sulfonamide derivatives as inhibitors of myeloid leukemia 1(MCL-1) protein | 普莱鲁德疗法有限公司 | 2021-07-23 | — | — | CN | disclosed |