Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.41 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.40 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.38 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11467252 | 0.99 | HDAC6 (0.43) | HDAC6HDAC8HDAC2HDAC1HDAC10 | |
| SCHEMBL11470640 | 0.93 | HDAC8 (0.42) | HDAC6HDAC8HDAC2HDAC1HDAC10 | |
| Oxalic Acid SCHEMBL11470690 | 0.91 | HDAC8 (0.41) | HDAC6HDAC8HDAC2HDAC1HDAC10 | |
| SCHEMBL11499454 | 0.89 | HDAC6 (0.44) | HDAC6HDAC8HDAC2HDAC1HDAC10 | |
| Hydrochloric Acid SCHEMBL11470685 | 0.88 | HDAC6 (0.43) | HDAC6HDAC8HDAC2HDAC1HDAC10 | |
| SCHEMBL11498371 | 0.86 | SSTR5 (0.42) | HDAC6HDAC8HDAC2HDAC1TBXA2R | |
| Hydrochloric Acid SCHEMBL11471583 | 0.86 | HDAC6 (0.42) | HDAC6HDAC8HDAC2HDAC1HDAC10 | |
| Hydrochloric Acid SCHEMBL11486433 | 0.85 | SSTR5 (0.42) | HDAC6HDAC8HDAC2HDAC1TBXA2R | |
| SCHEMBL11475559 | 0.82 | DCUN1D1 (0.41) | HDAC6HDAC8HDAC2TBXA2RPTGDR | |
| Hydrochloric Acid SCHEMBL11479030 | 0.80 | HDAC6 (0.41) | HDAC6HDAC8HDAC2HDAC1HDAC10 |
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-4181657-A | 2-Aminooctahydroindolo[2,3-a]quinolizines useful in treating cardiovascular disorders | MILES LABORATORIES, INC. (US) | 1980-01-01 | — | — | US | disclosed |