Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.37 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.36 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.33 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.33 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.33 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.33 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.33 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.33 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11542025 | 0.79 | MEN1 (0.38) | CA9PARP1POLB | |
| SCHEMBL8601620 | 0.79 | KDM4E (0.53) | CA1CA2CA7CA9ACHE | |
| SCHEMBL29341181 | 0.79 | S100A4 (0.38) | CA1CA2CA7CA9PARP1 | |
| SCHEMBL11547924 | 0.79 | PDE7A (0.42) | PARP1PARP10LRRK2 | |
| SCHEMBL11544646 | 0.79 | PBRM1 (0.44) | CA1CA2CA7CA9 | |
| SCHEMBL8599412 | 0.78 | KDM4E (0.54) | CA1CA2CA7CA9ACHE | |
| SCHEMBL29341252 | 0.78 | S100A4 (0.37) | CA1CA2CA7CA9PARP1 | |
| SCHEMBL11817638 | 0.78 | PARP1 (0.40) | CA1CA2CA7CA9ACHE | |
| SCHEMBL26790924 | 0.77 | CA1 (0.40) | CA1CA2CA7CA9ACHE | |
| SCHEMBL8596234 | 0.76 | GRIN1 (0.46) | CA1CA2CA7CA9ACHE |
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-4166183-A | TRICYCLIC CYCLITOLAMINES | E. R. SQUIBB & SONS, INC. (US) | 1979-08-28 | — | — | US | claimed |
| US-4172093-A | Pharmacodynamically active indan derivatives | AB KABI (SE) | 1979-10-23 | — | — | US | disclosed |