Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3949505 | 0.87 | ALDH1A1 (0.35) | ACHEALDH1A1KDM4ETDP1KMT2A | |
| SCHEMBL3955604 | 0.84 | ALDH1A1 (0.34) | ACHEALDH1A1KDM4ETDP1KMT2A | |
| SCHEMBL3947145 | 0.81 | MAPT (0.34) | ALDH1A1KDM4ETDP1KMT2ATP53 | |
| SCHEMBL1693004 | 0.77 | ALDH1A1 (0.34) | ALDH1A1KDM4EKMT2ATP53GAA | |
| SCHEMBL3947754 | 0.75 | CTSL (0.42) | ALDH1A1KDM4EKMT2AMMP2MMP9 | |
| SCHEMBL3947518 | 0.75 | MMP2 (0.36) | ALDH1A1KDM4EMMP2MMP9 | |
| SCHEMBL3954902 | 0.73 | KMT2A (0.47) | ALDH1A1KMT2ATP53MEN1RAB9A | |
| SCHEMBL3949961 | 0.69 | LMNA (0.33) | CYP2C19 | |
| SCHEMBL3954955 | 0.68 | PKM (0.36) | ALDH1A1KDM4ETDP1KMT2AMMP2 | |
| SCHEMBL3948771 | 0.68 | LMNA (0.33) | CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009026197-A1 | NOVEL CATHEPSIN C INHIBITORS AND THEIR USE | GLAXO GROUP LIMITED (GB) | 2009-02-26 | — | — | WO | disclosed |