Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.62 |
| ▸ | HTT | P42858 | 4/20 | 0.62 |
| ▸ | MAPT | P10636 | 4/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.62 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 4/20 | 0.51 |
| ▸ | RAB9A | P51151 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL12981083 | 0.78 | RAB9A (0.47) | MEN1KMT2AMAPTALDH1A1TSHR | |
| SCHEMBL11052606 | 0.78 | EPHX1 (0.58) | MEN1KMT2AHTTMAPTALDH1A1 | |
| SCHEMBL23959825 | 0.77 | MEN1 (0.57) | MEN1KMT2AHTTMAPTALDH1A1 | |
| SCHEMBL1491364 | 0.77 | HTT (0.57) | MEN1KMT2AHTTMAPTALDH1A1 | |
| SCHEMBL11526512 | 0.77 | CYP3A4 (0.62) | MEN1KMT2AHTTMAPTALDH1A1 | |
| SCHEMBL670295 | 0.77 | MEN1 (0.57) | MEN1KMT2AHTTMAPTALDH1A1 | |
| SCHEMBL19868628 | 0.77 | MEN1 (0.57) | MEN1KMT2AHTTMAPTALDH1A1 | |
| SCHEMBL24585192 | 0.77 | MEN1 (0.56) | MEN1KMT2AHTTMAPTALDH1A1 | |
| SCHEMBL23617483 | 0.77 | CYP3A4 (0.57) | MEN1KMT2AHTTMAPTALDH1A1 | |
| Hydrochloric Acid SCHEMBL25252460 | 0.76 | MEN1 (0.55) | MEN1KMT2AHTTMAPTALDH1A1 |
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-104321325-B | Pyrrolopyrrole alkanone compound | 诺华股份有限公司 | 2016-11-16 | — | — | CN | disclosed |