Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 5/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.42 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.39 |
| ▸ | NPY2R | P49146 | 3/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.38 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.38 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.37 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.37 |
| ▸ | CLK1 | P49759 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4809196 | 0.79 | RAB9A (0.51) | HDAC1HDAC3HDAC2BCL2L1OPRM1 | |
| SCHEMBL4819143 | 0.76 | HDAC1 (0.53) | HDAC1HDAC3HDAC2OPRM1HDAC4 | |
| SCHEMBL29525076 | 0.76 | MAPT (0.43) | TSHRKDM4EALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL4252197 | 0.74 | HDAC2 (0.44) | HDAC1HDAC3HDAC2BCL2L1OPRM1 | |
| SCHEMBL4817432 | 0.70 | HDAC1 (0.59) | HDAC1HDAC3HDAC2OPRM1HDAC4 | |
| SCHEMBL700108 | 0.69 | BCL2L1 (0.68) | HDAC1HDAC3HDAC2BCL2L1HDAC4 | |
| SCHEMBL29445494 | 0.69 | BCL2L1 (0.68) | HDAC1HDAC3HDAC2BCL2L1HDAC4 | |
| SCHEMBL21446740 | 0.68 | HDAC1 (0.58) | HDAC1HDAC3HDAC2BCL2L1HDAC4 | |
| SCHEMBL23128710 | 0.67 | PTPN11 (0.56) | TSHRKDM4EALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL447695 | 0.67 | RAB9A (0.57) | HDAC1HDAC3HDAC2OPRM1HDAC4 |
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-2006042035-A2 | METHOD OF MONITORING ANTI-TUMOR ACTIVITY OF AN HDAC INHIBITOR | PHARMACYCLICS, INC. (US) | 2006-04-20 | — | — | WO | disclosed |