Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 9/20 | 0.46 |
| ▸ | NPC1 | O15118 | 8/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6783862 | 0.82 | NPC1 (0.65) | HDAC6RAB9ANPC1KDM4EALDH1A1 | |
| SCHEMBL6889302 | 0.78 | NPC1 (0.56) | HDAC6RAB9ANPC1KDM4EALDH1A1 | |
| SCHEMBL6888788 | 0.78 | TP53 (0.58) | HDAC6RAB9ANPC1KDM4EALDH1A1 | |
| SCHEMBL8861233 | 0.77 | HDAC6 (0.62) | HDAC6RAB9ANPC1KDM4EALDH1A1 | |
| SCHEMBL6893111 | 0.77 | TP53 (0.54) | HDAC6RAB9ANPC1KDM4EALDH1A1 | |
| SCHEMBL6785535 | 0.76 | NPC1 (0.53) | HDAC6RAB9ANPC1KDM4EALDH1A1 | |
| SCHEMBL3975423 | 0.75 | KDM4E (0.69) | HDAC6RAB9ANPC1KDM4EALDH1A1 | |
| SCHEMBL6887169 | 0.74 | RAB9A (0.51) | HDAC6RAB9ANPC1KDM4EALDH1A1 | |
| SCHEMBL6790005 | 0.74 | HDAC6 (0.56) | HDAC6RAB9ANPC1KDM4EALDH1A1 | |
| SCHEMBL1161248 | 0.74 | HDAC6 (0.62) | HDAC6RAB9ANPC1KDM4EALDH1A1 |
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-6815442-B2 | A PHENOXY-ALKYL-QUINOXALINONE DERIVATIVES FOR INHIBITING DRUG TRANSPORT PROTEINS THAT EFFLUX THERAPEUTIC AGENTS FROM CELLS; SYNERGISTIC | THE PENN STATE RESEARCH FOUNDATION | 2004-11-09 | — | — | US | claimed |