Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAM | P19021 | 2/20 | 0.56 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.56 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.52 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.52 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.52 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.52 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.52 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.52 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.52 |
| ▸ | TNKS | O95271 | 1/20 | 0.52 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.52 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | PTGER4 | P35408 | 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 | |
|---|---|---|---|---|
| SCHEMBL13105277 | 0.94 | HAO1 (0.61) | PAMHAO1HDAC3HDAC4HDAC1 | |
| SCHEMBL7067334 | 0.85 | HAO1 (0.75) | PAMHAO1HDAC3HDAC4HDAC1 | |
| SCHEMBL10348520 | 0.85 | HAO1 (0.75) | PAMHAO1HDAC3HDAC4HDAC1 | |
| SCHEMBL2802853 | 0.83 | HDAC3 (0.68) | PAMHAO1HDAC3HDAC4HDAC1 | |
| SCHEMBL9437998 | 0.83 | HDAC3 (0.68) | PAMHAO1HDAC3HDAC4HDAC1 | |
| SCHEMBL316674 | 0.78 | HAO1 (0.84) | HAO1HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL3439644 | 0.78 | HAO1 (0.84) | HAO1HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL29053277 | 0.77 | HDAC3 (0.50) | PAMHAO1HDAC3HDAC4HDAC1 | |
| SCHEMBL9113934 | 0.76 | HAO1 (0.68) | PAMHAO1HDAC3HDAC4HDAC1 | |
| SCHEMBL9113928 | 0.76 | HAO1 (0.68) | PAMHAO1HDAC3HDAC4HDAC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6642035-B2 | Synthesis of B-keto esters | THE SCRIPPS RESEARCH INSTITUTE | 2003-11-04 | — | — | US | disclosed |
| US-20020102671-A1 | Synthesis of B-keto esters | SCRIPPS RESEARCH INSTITUTE, THE | 2002-08-01 | — | — | US | disclosed |