Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IAPP | P10997 | 5/20 | 0.53 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TOP2A | P11388 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 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 |
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 | |
|---|---|---|---|---|
| SCHEMBL19680073 | 0.81 | IAPP (0.45) | IAPPRAB9AALDH1A1NPC1KDM4E | |
| SCHEMBL9944607 | 0.80 | MAPT (0.46) | IAPPALDH1A1KDM4EAPPHTT | |
| SCHEMBL1481958 | 0.78 | P4HTM (0.54) | RAB9AALDH1A1KDM4EAPPKMT2A | |
| SCHEMBL1481960 | 0.78 | P4HTM (0.54) | RAB9AALDH1A1KDM4EAPPKMT2A | |
| SCHEMBL1704850 | 0.77 | CA12 (0.56) | RAB9AALDH1A1NPC1KDM4EAPP | |
| SCHEMBL1704853 | 0.77 | CA12 (0.56) | RAB9AALDH1A1NPC1KDM4EAPP | |
| SCHEMBL13928028 | 0.73 | HDAC8 (0.42) | ALDH1A1KDM4EAPPKMT2AHDAC3 | |
| SCHEMBL1320223 | 0.73 | ESR1 (0.37) | ALDH1A1KDM4EHTTKMT2AHDAC3 | |
| SCHEMBL1320221 | 0.73 | ESR1 (0.37) | ALDH1A1KDM4EHTTKMT2AHDAC3 | |
| SCHEMBL22811244 | 0.72 | MAPT (0.44) | ALDH1A1KDM4EHTTL3MBTL1POLB |
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-2012025701-A1 | ALPHA, ALPHA - DI SUBSTITUTED GLYCINE ESTER DERIVATIVES AND THEIR USE AS HDAC INHIBITORS | CHROMA THERAPEUTICS LTD. (GB) | 2012-03-01 | — | — | WO | disclosed |