Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.60 |
| ▸ | RAB9A | P51151 | 6/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.60 |
| ▸ | MEN1 | O00255 | 3/20 | 0.60 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | CASP3 | P42574 | 1/20 | 0.55 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.55 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.54 |
| ▸ | TP53 | P04637 | 4/20 | 0.54 |
| ▸ | TSHR | P16473 | 3/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.52 |
| ▸ | GRM5 | P41594 | 1/20 | 0.52 |
| ▸ | GLA | P06280 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL28690660 | 1.00 | NPC1 (0.60) | NPC1RAB9AKMT2AMEN1KCNK3 | |
| SCHEMBL28684553 | 0.87 | PTPN1 (0.53) | NPC1RAB9AKMT2AMEN1KCNK3 | |
| SCHEMBL28704847 | 0.86 | NPC1 (0.47) | NPC1RAB9AKMT2AMEN1KCNK3 | |
| SCHEMBL29390013 | 0.86 | NPC1 (0.47) | NPC1RAB9AKMT2AMEN1KCNK3 | |
| SCHEMBL28700619 | 0.86 | RAB9A (0.59) | NPC1RAB9AKMT2AMEN1KCNK3 | |
| SCHEMBL28698368 | 0.85 | LMNA (0.66) | NPC1RAB9AKMT2AMEN1KCNK3 | |
| SCHEMBL29389710 | 0.85 | KCNK3 (0.59) | NPC1RAB9AKMT2AMEN1KCNK3 | |
| SCHEMBL28691389 | 0.85 | RAB9A (0.51) | NPC1RAB9AKMT2AMEN1KDM4E | |
| SCHEMBL28708129 | 0.85 | KCNK3 (0.59) | NPC1RAB9AKMT2AMEN1KCNK3 | |
| SCHEMBL28704845 | 0.85 | KCNK3 (0.59) | NPC1RAB9AKMT2AMEN1KCNK3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114057630-B | Pirfenidone derivative and synthetic method and application thereof | 郑州大学 | 2023-06-02 | — | — | CN | claimed |
| CN-114057630-A | Pirfenidone derivative and synthetic method and application thereof | 郑州大学 | 2022-02-18 | — | — | CN | claimed |
| CN-114057630-A | Pirfenidone derivative and synthetic method and application thereof | 郑州大学 | 2022-02-18 | — | — | CN | disclosed |