Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 14/20 | 0.46 |
| ▸ | NPC1 | O15118 | 10/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | TP53 | P04637 | 3/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 8/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.45 |
| ▸ | RELA | Q04206 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | GLA | P06280 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5323085 | 0.81 | RAB9A (0.49) | RAB9ANPC1KDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL713163 | 0.75 | RAB9A (0.50) | RAB9ANPC1KDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL827403 | 0.74 | RAB9A (0.67) | RAB9ANPC1KDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL29528497 | 0.73 | NPC1 (0.56) | RAB9ANPC1KDM4ESMN1; SMN2ALDH1A1 | |
| Hydrogen Sulfide SCHEMBL28205214 | 0.72 | RAB9A (0.64) | RAB9ANPC1KDM4ESMN1; SMN2ALDH1A1 | |
| Hydrogen Sulfide SCHEMBL16859912 | 0.72 | RAB9A (0.64) | RAB9ANPC1KDM4ESMN1; SMN2ALDH1A1 | |
| Methane SCHEMBL28056221 | 0.72 | RAB9A (0.64) | RAB9ANPC1KDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL6642970 | 0.72 | RAB9A (0.51) | RAB9ANPC1KDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL15987517 | 0.72 | RAB9A (0.47) | RAB9ANPC1KDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL3073946 | 0.71 | RAB9A (0.69) | RAB9ANPC1KDM4ESMN1; SMN2ALDH1A1 |
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-116981670-A | Polycyclic compound containing nitrogen heterocycle, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2023-10-31 | — | — | CN | disclosed |