Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | MGLL | Q99685 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | DAO | P14920 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MEP1A | Q16819 | 1/20 | 0.39 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.39 |
| ▸ | PHGDH | O43175 | 2/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | GSK3A | P49840 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19468036 | 0.82 | IDO1 (0.53) | PKMMGLLALDH1A1NPC1RAB9A | |
| SCHEMBL19494605 | 0.80 | PKM (0.45) | PKMMGLLALDH1A1NPC1RAB9A | |
| SCHEMBL19468028 | 0.80 | TAAR1 (0.54) | PKMMGLLALDH1A1DAONPC1 | |
| SCHEMBL19468376 | 0.78 | RAB9A (0.47) | PKMMGLLALDH1A1NPC1RAB9A | |
| SCHEMBL19468181 | 0.78 | ALDH1A1 (0.47) | PKMMGLLALDH1A1NPC1RAB9A | |
| SCHEMBL148444 | 0.77 | MGLL (0.59) | PKMMGLLALDH1A1NPC1RAB9A | |
| SCHEMBL19468385 | 0.76 | CYP1A2 (0.49) | PKMALDH1A1SMN1; SMN2MAPTHTT | |
| SCHEMBL19468237 | 0.75 | EPHX1 (0.47) | ALDH1A1SMN1; SMN2EPHX1MAPTKMT2A | |
| SCHEMBL3143432 | 0.75 | MGLL (0.56) | PKMMGLLALDH1A1NPC1RAB9A | |
| SCHEMBL25798171 | 0.75 | IDO1 (0.46) | ALDH1A1DAOGLAEPHX1TP53 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3235815-A1 | AGENTS AGAINST PARASITIC HELMINTHS | PHILIPPS-UNIVERSITÄT MARBURG (DE) | 2017-10-25 | — | — | EP | disclosed |
| EP-3235815-A1 | AGENTS AGAINST PARASITIC HELMINTHS | PHILIPPS-UNIVERSITÄT MARBURG (DE) | 2017-10-25 | — | — | EP | disclosed |