Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | METAP2 | P50579 | 1/20 | 0.44 |
| ▸ | PLAU | P00749 | 1/20 | 0.44 |
| ▸ | NCF1 | P14598 | 1/20 | 0.44 |
| ▸ | MPO | P05164 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 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 | |
|---|---|---|---|---|
| SCHEMBL9471806 | 0.84 | METAP2 (0.49) | HDAC1HDAC2HDAC8HDAC6CYP1A2 | |
| SCHEMBL8344444 | 0.82 | KDM4E (0.52) | HDAC8CYP1A2HIF1AALOX15KMT2A | |
| SCHEMBL19622955 | 0.81 | CA12 (0.46) | HDAC8CYP1A2HIF1AALOX15KMT2A | |
| SCHEMBL360767 | 0.81 | KMT2A (0.49) | CYP1A2HIF1AKMT2ALMNATDP1 | |
| SCHEMBL7562315 | 0.81 | KMT2A (0.50) | HDAC1HDAC2HDAC8HDAC6CYP1A2 | |
| SCHEMBL7133311 | 0.80 | KCNH2 (0.56) | HDAC8CYP1A2HIF1AKMT2ALMNA | |
| Hydrochloric Acid SCHEMBL6053093 | 0.80 | KMT2A (0.47) | CYP1A2HIF1AKMT2ALMNATDP1 | |
| SCHEMBL12593364 | 0.78 | METAP2 (0.49) | HDAC8CYP1A2HIF1AALOX15KMT2A | |
| SCHEMBL4040914 | 0.77 | KMT2A (0.45) | HDAC8HDAC6CYP1A2HIF1ACYP2D6 | |
| SCHEMBL31238931 | 0.76 | MEN1 (0.54) | PKMHDAC1KMT2ATDP1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-104994853-A | Dihydro-6-azaphenalene derivatives for the treatment of cns, oncological diseases and related disorders | WARNER BABCOCK INST FOR GREEN CHEMISTRY LLC | 2015-10-21 | — | — | CN | disclosed |