Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 2/20 | 0.57 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.57 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.55 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.55 |
| ▸ | F11 | P03951 | 2/20 | 0.53 |
| ▸ | SUCNR1 | Q9BXA5 | 2/20 | 0.53 |
| ▸ | CFD | P00746 | 2/20 | 0.53 |
| ▸ | TPSB2 | P20231 | 1/20 | 0.53 |
| ▸ | MDM4 | O15151 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL7511265 | 0.97 | HDAC3 (0.61) | HDAC3HDAC1HDAC2MAPK1KCNK3 | |
| SCHEMBL23230036 | 0.85 | GAA (0.55) | HDAC3HDAC1HDAC2MAPK1KCNK3 | |
| SCHEMBL28767764 | 0.84 | SUCNR1 (0.58) | HDAC3HDAC1HDAC2MAPK1KCNK3 | |
| SCHEMBL28242708 | 0.83 | SUCNR1 (0.71) | HDAC3HDAC1HDAC2KCNK3KCNK9 | |
| SCHEMBL27483868 | 0.82 | GAA (0.50) | HDAC3HDAC1HDAC2F11SUCNR1 | |
| SCHEMBL528445 | 0.81 | KCNK3 (0.77) | HDAC3HDAC1HDAC2MAPK1KCNK3 | |
| SCHEMBL3635005 | 0.80 | ALDH1A1 (0.47) | HDAC3HDAC1HDAC2KCNK3KCNK9 | |
| SCHEMBL28201120 | 0.80 | KMT2A (0.72) | HDAC2KCNK3KCNK9F11SUCNR1 | |
| SCHEMBL27758988 | 0.80 | GAA (0.58) | HDAC3HDAC1HDAC2MAPK1NPC1 | |
| SCHEMBL27841708 | 0.80 | MAPT (0.48) | HDAC3HDAC1HDAC2MAPK1KCNK3 |
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 |
|---|---|---|---|---|---|---|---|
| US-20020032262-A1 | 2-aminoarylmethylamine solid support templated for preparation of highly functionalized heterocycle compounds | ZHANG JINFANG (US) | 2002-03-14 | — | — | US | disclosed |