Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALM1 | P0DP23 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | BCL2 | P10415 | 1/20 | 0.33 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.33 |
| ▸ | IDH1 | O75874 | 1/20 | 0.33 |
| ▸ | LTA4H | P09960 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.32 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27812397 | 0.82 | NPC1 (0.40) | RAB9AALDH1A1SMN1; SMN2TDP1NPC1 | |
| SCHEMBL11373366 | 0.77 | TSHR (0.54) | LTA4HLMNATSHRTAAR1DAO | |
| Diphenylmethane SCHEMBL28948706 | 0.69 | CALM1 (0.71) | CALM1RAB9AALDH1A1SMN1; SMN2TDP1 | |
| SCHEMBL110859 | 0.69 | CALM1 (0.52) | CALM1ALDH1A1BCL2BCL2L1IDH1 | |
| SCHEMBL1923108 | 0.67 | CALM1 (0.58) | CALM1ALDH1A1BCL2BCL2L1IDH1 | |
| SCHEMBL28831761 | 0.67 | CALM1 (0.50) | CALM1ALDH1A1BCL2BCL2L1IDH1 | |
| SCHEMBL27931008 | 0.67 | CALM1 (0.50) | CALM1ALDH1A1BCL2BCL2L1IDH1 | |
| Hydrochloric Acid SCHEMBL28817569 | 0.67 | CALM1 (0.50) | CALM1ALDH1A1SMN1; SMN2BCL2BCL2L1 | |
| SCHEMBL6684516 | 0.66 | NPC1 (0.43) | CALM1RAB9AALDH1A1SMN1; SMN2TDP1 | |
| SCHEMBL19102829 | 0.66 | CALM1 (0.55) | CALM1ALDH1A1SORT1BCL2BCL2L1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101820760-A | Condensed hetero ring | SEPRACOR INC | 2010-09-01 | — | — | CN | disclosed |
| EP-2173170-A2 | FUSED HETEROCYCLES | Sepracor Inc. (US) | 2010-04-14 | — | — | EP | disclosed |
| CN-101511832-A | Fused heterocyclic inhibitors of D-amino acid oxidase | SEPRACOR INC (US) | 2009-08-19 | — | — | CN | disclosed |
| WO-2009020814-A2 | FUSED HETEROCYCLES | SEPRACOR INC. (US) | 2009-02-12 | — | — | WO | disclosed |