Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | CACNA1G | O43497 | 2/20 | 0.50 |
| ▸ | CACNA1H | O95180 | 2/20 | 0.50 |
| ▸ | CACNA1I | Q9P0X4 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL15964805 | 0.82 | NPC1 (0.48) | KMT2AMEN1NPC1RAB9ACACNA1G | |
| SCHEMBL4288842 | 0.78 | HDAC1 (0.56) | KMT2AMEN1NPC1RAB9ACACNA1G | |
| SCHEMBL3440017 | 0.76 | KMT2A (0.66) | KMT2AMEN1NPC1RAB9ACACNA1G | |
| SCHEMBL29049999 | 0.76 | KMT2A (0.51) | KMT2AMEN1NPC1RAB9ACACNA1G | |
| SCHEMBL4726770 | 0.76 | SMN1; SMN2 (0.50) | KMT2AMEN1NPC1RAB9ACACNA1G | |
| SCHEMBL29757100 | 0.75 | KLKB1 (0.45) | RAB9ALMNAKDM4EMAPTSMN1; SMN2 | |
| SCHEMBL22888044 | 0.75 | KLKB1 (0.45) | RAB9ALMNAKDM4EMAPTSMN1; SMN2 | |
| SCHEMBL15964729 | 0.75 | PTGER1 (0.56) | KDM4ETSHR | |
| SCHEMBL15520038 | 0.74 | LMNA (0.40) | KMT2AMEN1NPC1RAB9ACACNA1G | |
| SCHEMBL3439964 | 0.74 | CACNA1G (0.64) | KMT2AMEN1NPC1RAB9ACACNA1G |
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-106573006-A | Heterocyclic amides of RIP1 kinase inhibitors as pharmaceuticals | 葛兰素史密斯克莱知识产权发展有限公司 | 2017-04-19 | — | — | CN | disclosed |