Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.54 |
| ▸ | GRM5 | P41594 | 1/20 | 0.45 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9142579 | 0.83 | KEAP1 (0.69) | KEAP1POLBPDPK1GRM5KMT2A | |
| Methylene Chloride SCHEMBL11485680 | 0.78 | KEAP1 (0.61) | KEAP1POLBPDPK1GRM5KMT2A | |
| SCHEMBL30690400 | 0.77 | KEAP1 (0.70) | KEAP1POLBPDPK1GRM5KMT2A | |
| SCHEMBL3790885 | 0.77 | KEAP1 (0.70) | KEAP1POLBPDPK1GRM5KMT2A | |
| SCHEMBL27580164 | 0.76 | KEAP1 (0.58) | KEAP1POLBPDPK1GRM5KMT2A | |
| SCHEMBL9140155 | 0.76 | KEAP1 (0.58) | KEAP1PDPK1GRM5KMT2ANPC1 | |
| SCHEMBL9141346 | 0.76 | KEAP1 (0.58) | KEAP1POLBPDPK1GRM5KMT2A | |
| SCHEMBL9142182 | 0.75 | KEAP1 (0.54) | KEAP1POLBPDPK1GRM5KMT2A | |
| SCHEMBL28844096 | 0.75 | TUBB1 (0.65) | KEAP1PDPK1 | |
| SCHEMBL29738647 | 0.74 | POLB (0.69) | POLBPARP1KMT2ANPC1RAB9A |
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-108003085-A | A kind of synthetic method of pharmaceutical intermediate sweet-smelling formacyl indole derivatives | 张开良 | 2018-05-08 | — | — | CN | disclosed |