Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 5/20 | 0.56 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.56 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.55 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL22106236 | 1.00 | HDAC1 (0.56) | HDAC1HDAC4KCNH2HDAC6HDAC8 | |
| SCHEMBL16809276 | 0.87 | HDAC6 (0.58) | HDAC1HDAC4KCNH2HDAC6HDAC8 | |
| SCHEMBL8385135 | 0.86 | HDAC6 (0.74) | HDAC1HDAC4KCNH2HDAC6HDAC8 | |
| SCHEMBL22984085 | 0.85 | FOLH1 (0.59) | HDAC1HDAC6ALDH1A1KMT2AMEN1 | |
| SCHEMBL18811733 | 0.82 | POLB (0.59) | HDAC1HDAC4KCNH2HDAC6HDAC8 | |
| SCHEMBL18811731 | 0.82 | POLB (0.59) | HDAC1HDAC4KCNH2HDAC6HDAC8 | |
| SCHEMBL22361385 | 0.81 | KDM4E (0.63) | ALDH1A1KMT2AKDM4EMEN1RAB9A | |
| SCHEMBL18292042 | 0.81 | KDM4E (0.63) | ALDH1A1KMT2AKDM4EMEN1RAB9A | |
| SCHEMBL18292063 | 0.81 | KDM4E (0.63) | ALDH1A1KMT2AKDM4EMEN1RAB9A | |
| SCHEMBL4424464 | 0.81 | ALDH1A1 (0.57) | HDAC1HDAC4KCNH2HDAC6HDAC8 |
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-2017075171-A2 | PAMAM DENDRIMER BASED CEST IMAGING AGENTS AND USES THEREOF | THE JOHNS HOPKINS UNIVERSITY (US) | 2017-05-04 | — | — | WO | disclosed |