Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 7/20 | 0.46 |
| ▸ | NPC1 | O15118 | 6/20 | 0.46 |
| ▸ | HPGD | P15428 | 5/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL7711697 | 0.89 | ADORA2A (0.35) | ALDH1A1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL7708391 | 0.88 | ADORA2A (0.45) | ALDH1A1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL7708828 | 0.87 | RAB9A (0.51) | ALDH1A1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL7708891 | 0.87 | KDM4E (0.49) | ALDH1A1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL7708813 | 0.83 | NPC1 (0.37) | ALDH1A1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL7709121 | 0.83 | CSNK1D (0.42) | ALDH1A1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL7703234 | 0.82 | ADORA2A (0.38) | ALDH1A1MEN1RAB9ANPC1HPGD | |
| SCHEMBL7711750 | 0.81 | ADORA2A (0.57) | ALDH1A1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL7703218 | 0.81 | NOTUM (0.37) | ALDH1A1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL7711711 | 0.81 | ALDH1A1 (0.44) | ALDH1A1KDM4ETP53RAB9ANPC1 |
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-6355653-B1 | DRUG AND CARRIER FOR ANTIALLERGENS, BRAIN DISORDERS AND NEUROTRANSMITTERS | HOFFMANN-LA ROCHE INC. | 2002-03-12 | — | — | US | disclosed |