Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | F13A1 | P00488 | 1/20 | 0.45 |
| ▸ | PLK1 | P53350 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.43 |
| ▸ | TPSAB1 | Q15661 | 2/20 | 0.43 |
| ▸ | PRSS1 | P07477 | 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 | |
|---|---|---|---|---|
| SCHEMBL19234514 | 0.88 | KMT2A (0.61) | ALDH1A1KMT2AHDAC1HDAC3HDAC2 | |
| SCHEMBL14679449 | 0.83 | KMT2A (0.57) | ALDH1A1KMT2AHPGDPOLBRAB9A | |
| SCHEMBL24324826 | 0.82 | POLB (0.56) | ALDH1A1KMT2AHDAC1HDAC3HDAC2 | |
| SCHEMBL7529131 | 0.81 | GAA (0.59) | ALDH1A1KMT2AHPGDKDM4EEPHX2 | |
| SCHEMBL12839912 | 0.79 | TPSAB1 (0.52) | ALDH1A1KMT2AHDAC1HDAC3HDAC2 | |
| SCHEMBL7430277 | 0.78 | L3MBTL1 (0.56) | ALDH1A1KMT2AHDAC1HDAC3HDAC2 | |
| SCHEMBL23442296 | 0.78 | ALDH1A1 (0.50) | ALDH1A1KMT2AHDAC1HDAC3HDAC2 | |
| SCHEMBL13181415 | 0.77 | KMT2A (0.61) | ALDH1A1KMT2AHDAC1HDAC3HDAC2 | |
| SCHEMBL6845396 | 0.77 | KDM4E (0.72) | ALDH1A1HDAC1HDAC3HDAC2HPGD | |
| SCHEMBL25496727 | 0.77 | ALDH1A1 (0.54) | ALDH1A1HDAC1HDAC3HDAC2HPGD |
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-2011037833-A2 | NOVEL N-BENZYLAMIDE SUBSTITUTED DERIVATIVES OF 2-(ACYLAMIDO)ACETIC ACID AND 2-(ACYLAMIDO)PROPIONIC ACIDS: POTENT NEUROLOGICAL AGENTS | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 2011-03-31 | — | — | WO | disclosed |