Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 5/20 | 0.42 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CFTR | P13569 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | PDE2A | O00408 | 1/20 | 0.36 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.36 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.36 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14192020 | 1.00 | IDO1 (0.42) | IDO1FFAR2ALDH1A1LMNAMAPT | |
| SCHEMBL14192006 | 0.91 | KCNQ2 (0.39) | IDO1ALDH1A1GAACFTRMEN1 | |
| SCHEMBL27679154 | 0.90 | DGAT2 (0.39) | ALDH1A1LMNAGAACFTRPDE2A | |
| SCHEMBL14192022 | 0.90 | GAA (0.38) | IDO1GAACFTRMEN1KMT2A | |
| SCHEMBL14192016 | 0.90 | DGAT2 (0.39) | ALDH1A1LMNAGAACFTRPDE2A | |
| SCHEMBL28769271 | 0.90 | GAA (0.38) | IDO1GAACFTRMEN1KMT2A | |
| SCHEMBL14192012 | 0.90 | GAA (0.49) | ALDH1A1LMNAMAPTNPSR1TDP1 | |
| SCHEMBL14192026 | 0.90 | DGAT2 (0.40) | IDO1ALDH1A1CFTRMEN1KMT2A | |
| SCHEMBL27698245 | 0.90 | DGAT2 (0.40) | IDO1ALDH1A1CFTRMEN1KMT2A | |
| SCHEMBL14192019 | 0.90 | KCNQ2 (0.40) | IDO1ALDH1A1LMNAMAPTNPSR1 |
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-101052398-A | N-(pyridin-3-yl)-2-phenylbutanamides as androgen receptor modulators | MERCK & CO INC (US) | 2007-10-10 | — | — | CN | disclosed |