Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 10/20 | 0.65 |
| ▸ | RAB9A | P51151 | 9/20 | 0.65 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.65 |
| ▸ | LMNA | P02545 | 2/20 | 0.65 |
| ▸ | METAP2 | P50579 | 1/20 | 0.65 |
| ▸ | METAP1 | P53582 | 1/20 | 0.65 |
| ▸ | MEN1 | O00255 | 3/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | BLM | P54132 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.56 |
| ▸ | PPARG | P37231 | 1/20 | 0.55 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.55 |
| ▸ | RECQL | P46063 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL2628996 | 0.80 | NPC1 (0.76) | NPC1RAB9AL3MBTL1SMN1; SMN2LMNA | |
| SCHEMBL1897970 | 0.79 | NPC1 (1.00) | NPC1RAB9AL3MBTL1SMN1; SMN2LMNA | |
| SCHEMBL27882367 | 0.78 | NPC1 (0.61) | NPC1RAB9AL3MBTL1SMN1; SMN2LMNA | |
| SCHEMBL6646541 | 0.76 | P2RX7 (0.54) | NPC1RAB9ASMN1; SMN2LMNAMEN1 | |
| SCHEMBL14880181 | 0.75 | NPC1 (0.61) | NPC1RAB9AL3MBTL1SMN1; SMN2LMNA | |
| SCHEMBL20029051 | 0.75 | RAB9A (0.61) | NPC1RAB9AL3MBTL1SMN1; SMN2LMNA | |
| SCHEMBL28801036 | 0.74 | NPC1 (0.72) | NPC1RAB9AL3MBTL1SMN1; SMN2LMNA | |
| SCHEMBL13726856 | 0.74 | GRM4 (0.66) | L3MBTL1MEN1KMT2AKDM4EP2RX7 | |
| SCHEMBL995829 | 0.73 | NPC1 (1.00) | NPC1RAB9AL3MBTL1SMN1; SMN2LMNA | |
| SCHEMBL37633 | 0.73 | P2RX7 (0.69) | ALDH1A1P2RX7 |
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-102238950-B | Certain kynurenine-3-monooxygenase inhibitors, pharmaceutical compositions, and methods of use | CHDI FOUNDATION INC (US) | 2014-05-07 | — | — | CN | disclosed |