Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | CYP1A1 | P04798 | 6/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 6/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | PLAU | P00749 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | EIF4E | P06730 | 2/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL16536057 | 0.83 | ALDH1A1 (0.51) | ALDH1A1MEN1MAPTRAB9AKMT2A | |
| SCHEMBL20197302 | 0.82 | SMN1; SMN2 (0.46) | ALDH1A1MEN1MAPTRAB9AKMT2A | |
| SCHEMBL20197440 | 0.80 | KDM4E (0.36) | MEN1MAPTRAB9AKMT2ASMN1; SMN2 | |
| SCHEMBL20197221 | 0.78 | SREBF2 (0.55) | ALDH1A1MAPTKDM4EATM | |
| SCHEMBL20197336 | 0.78 | CYP19A1 (0.46) | MEN1MAPTRAB9AKMT2ASMN1; SMN2 | |
| SCHEMBL22152727 | 0.77 | SREBF2 (0.43) | ALDH1A1MAPTKDM4EATM | |
| SCHEMBL20197228 | 0.77 | CYP1A1 (0.42) | ALDH1A1MEN1MAPTRAB9AKMT2A | |
| SCHEMBL20197249 | 0.76 | SREBF2 (0.43) | ALDH1A1MAPTKDM4EATM | |
| SCHEMBL20197318 | 0.76 | EIF4E (0.46) | RAB9ASMN1; SMN2KDM4ECYP1A1CYP1B1 | |
| SCHEMBL20197309 | 0.76 | CYP1B1 (0.41) | ALDH1A1MEN1MAPTRAB9AKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3038622-B1 | HETEROCYCLIC COMPOUNDS AND METHODS OF USE | MEDIVATION TECH LLC (US) | 2018-05-30 | — | — | EP | disclosed |