Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.44 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.43 |
| ▸ | HRH1 | P35367 | 1/20 | 0.43 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 2/20 | 0.42 |
| ▸ | NMT1 | P30419 | 1/20 | 0.42 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.41 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3039429 | 0.85 | METTL3 (0.49) | HDAC1HDAC6CHEK2KDM1ANPC1 | |
| SCHEMBL3025802 | 0.82 | HDAC1 (0.45) | HDAC1HDAC6CYP4A11HRH1KDM1A | |
| SCHEMBL13086758 | 0.82 | MEN1 (0.50) | NPC1MEN1RAB9AKMT2AFKBP1A | |
| SCHEMBL3042734 | 0.82 | HDAC1 (0.46) | HDAC1HDAC6CHEK2KDM1ANPC1 | |
| SCHEMBL7982886 | 0.82 | KDM1A (0.45) | CHEK2KDM1AATMMEN1KMT2A | |
| SCHEMBL3040839 | 0.82 | LTA4H (0.46) | HDAC1HDAC6CHEK2KDM1ANPC1 | |
| SCHEMBL29939753 | 0.81 | NPC1 (0.48) | HDAC1HDAC6CHEK2KDM1ANPC1 | |
| SCHEMBL7495311 | 0.81 | GPR119 (0.53) | HDAC1HDAC6CYP4A11CYP4F2KMT2A | |
| SCHEMBL23116888 | 0.80 | ATM (0.46) | CHEK2KDM1AATMMEN1KMT2A | |
| SCHEMBL21357556 | 0.80 | ATM (0.46) | CHEK2KDM1AATMMEN1KMT2A |
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-6265434-B1 | ANTIINFLAMMATORY AGENTS | MERCK & CO., INC. | 2001-07-24 | — | — | US | disclosed |