Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | MAPT | P10636 | 5/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | STAT3 | P40763 | 1/20 | 0.39 |
| ▸ | GPR3 | P46089 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | NQO2 | P16083 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3672070 | 1.00 | ALDH1A1 (0.44) | ALDH1A1MAPTCYP1A2KDM4EHSD17B10 | |
| SCHEMBL31290951 | 0.88 | ALDH1A1 (0.40) | ALDH1A1MAPTCYP1A2KDM4EHSD17B10 | |
| SCHEMBL27809942 | 0.79 | CYP1A2 (0.48) | ALDH1A1MAPTCYP1A2KDM4EHSD17B10 | |
| SCHEMBL31003174 | 0.79 | CYP1A2 (0.48) | ALDH1A1MAPTCYP1A2KDM4EHSD17B10 | |
| Water SCHEMBL27809943 | 0.77 | CYP1A2 (0.47) | ALDH1A1MAPTCYP1A2KDM4EHSD17B10 | |
| SCHEMBL13836819 | 0.75 | KMT2A (0.49) | ALDH1A1KDM4EHPGDGAAL3MBTL1 | |
| SCHEMBL11327423 | 0.74 | MAPT (0.47) | ALDH1A1MAPTCYP1A2KDM4EHSD17B10 | |
| SCHEMBL14993411 | 0.72 | CYP1A2 (0.45) | ALDH1A1MAPTCYP1A2KDM4EHSD17B10 | |
| SCHEMBL13837206 | 0.70 | MBNL1 (0.44) | ALDH1A1MAPTL3MBTL1SMN1; SMN2MEN1 | |
| SCHEMBL13837134 | 0.70 | PRKAA2 (0.36) | ALDH1A1CYP1A2L3MBTL1POLBSCN9A |
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-2006034269-A1 | EXPEDITIOUS SYNTHESIS OF DPD | THE TRUSTEES OF PRINCETON UNIVERSITY (US) | 2006-03-30 | — | — | WO | disclosed |