Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 4/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL5969931 | 0.79 | HDAC3 (0.44) | KIF11CYP1A2CYP2C19HIF1AHDAC3 | |
| SCHEMBL4185722 | 0.79 | MAPT (0.42) | KIF11CYP1A2KMT2AMEN1TSHR | |
| SCHEMBL5311804 | 0.79 | MAPT (0.42) | KIF11CYP1A2KMT2AMEN1TSHR | |
| Hydrochloric Acid SCHEMBL6820036 | 0.77 | HDAC3 (0.43) | KIF11CYP1A2CYP2C19HIF1AHDAC3 | |
| SCHEMBL18799433 | 0.77 | CACNA1F (0.44) | CYP1A2CYP3A4RECQLHIF1AKMT2A | |
| SCHEMBL9037241 | 0.77 | KCNN4 (0.45) | KIF11CYP1A2CYP2C19HIF1AHDAC3 | |
| SCHEMBL11128706 | 0.77 | KCNN4 (0.45) | KIF11CYP1A2CYP2C19HIF1AHDAC3 | |
| SCHEMBL10901575 | 0.77 | KCNN4 (0.45) | KIF11CYP1A2CYP2C19HIF1AHDAC3 | |
| SCHEMBL10749410 | 0.75 | CYP1A2 (0.49) | CYP1A2CYP3A4RECQLCYP2C19HIF1A | |
| SCHEMBL4795574 | 0.73 | KCNN4 (0.41) | KIF11CYP1A2CYP2C19HIF1AHDAC3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004043355-A2 | ALPHA, ALPHA-DISUBSTITUTED BENZYLGLYCINE DERIVATIVES AS HIV PROTEASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2004-05-27 | — | — | WO | disclosed |