Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MC4R | P32245 | 1/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL14387318 | 0.84 | PRMT1 (0.57) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL24799638 | 0.82 | MC4R (0.53) | MC4RHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL3453981 | 0.76 | CYP2D6 (0.73) | MC4RHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL1481516 | 0.76 | HDAC6 (0.58) | MC4RHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL31721203 | 0.76 | CYP2D6 (0.73) | MC4RHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL13535291 | 0.76 | MC4R (0.74) | MC4RKDM4EALDH1A1MAPTCHKA | |
| SCHEMBL10145077 | 0.76 | ALDH1A1 (0.60) | MC4RHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL31721209 | 0.76 | ALDH1A1 (0.60) | MC4RHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL16358261 | 0.75 | HDAC6 (0.52) | MC4RHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL608151 | 0.75 | CYP2D6 (0.54) | HDAC1KDM4ECYP2D6CYP2C9HIF1A |
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-2007137196-A2 | TUBULIN BINDING ANTI CANCER COMPOUNDS AND PRODRUGS THEREOF | THRESHOLD PHARMACEUTICALS, INC. (US) | 2007-11-29 | — | — | WO | disclosed |