Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.34 |
| ▸ | MGLL | Q99685 | 2/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.34 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.34 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | CNR1 | P21554 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 2/20 | 0.33 |
| ▸ | CDC25A | P30304 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8107632 | 0.89 | ADRA2A (0.36) | ALDH1A1TP53MAPK1ALDH2ALDH3A1 | |
| SCHEMBL8103441 | 0.73 | KDM4E (0.38) | ALDH1A1TP53MAPK1PTGS1PTGS2 | |
| SCHEMBL8101881 | 0.70 | ALDH1A1 (0.43) | ALDH1A1TP53MAPK1ALDH2ALDH3A1 | |
| SCHEMBL8101553 | 0.68 | GAA (0.38) | ALDH1A1TP53MAPK1KMT2AMEN1 | |
| SCHEMBL15644072 | 0.65 | ALDH1A1 (0.59) | ALDH1A1TP53MAPK1PTGS1PTGS2 | |
| SCHEMBL31314370 | 0.64 | ALDH1A1 (0.44) | ALDH1A1TP53KMT2ACNR1MEN1 | |
| SCHEMBL8103457 | 0.64 | ALDH1A1 (0.44) | ALDH1A1TP53MAPK1ALDH2ALDH3A1 | |
| Bromide SCHEMBL2590637 | 0.63 | DRD2 (0.50) | ALDH1A1TP53KMT2ACNR1MEN1 | |
| SCHEMBL3635173 | 0.63 | CDC25A (0.61) | ALDH1A1PTGS1PTGS2MGLLFAAH | |
| SCHEMBL3023529 | 0.62 | CNR1 (0.42) | ALDH1A1TP53MAPK1PTGS1PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6127369-A | 5,10-dihydrodipyrido[2,3-b:2,3-e]pyrazin and 5,10-dihydrodipyrido[2,3-b:3,2-e]pyrazin compounds | ADIR ET COMPAGNIE (FR) | 2000-10-03 | — | — | US | disclosed |