Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 6/20 | 0.37 |
| ▸ | CA12 | O43570 | 4/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.35 |
| ▸ | XPO1 | O14980 | 1/20 | 0.35 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.34 |
| ▸ | WNT3A | P56704 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.31 |
| ▸ | TUBB | P07437 | 1/20 | 0.31 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.31 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.31 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12277842 | 0.89 | CA2 (0.32) | CA2CA12PDE10AMAPTTSHR | |
| SCHEMBL12278248 | 0.85 | CA2 (0.32) | CA2CA12PDE10AMAPTTSHR | |
| SCHEMBL5039563 | 0.78 | GPR35 (0.42) | CA2CA12XPO1MAPTTSHR | |
| SCHEMBL8148547 | 0.78 | CA2 (0.40) | CA2CA12CYP2A6CTNNB1WNT3A | |
| SCHEMBL15040947 | 0.76 | CYP2A6 (0.37) | CA2CA12CYP2A6CTNNB1WNT3A | |
| SCHEMBL164774 | 0.76 | CYP2A6 (0.50) | CA2CA12CYP2A6CTNNB1WNT3A | |
| SCHEMBL148089 | 0.75 | DYRK1A (0.40) | CYP2A6CTNNB1WNT3ADYRK1A | |
| SCHEMBL3480255 | 0.74 | PDE10A (0.48) | CYP2A6CTNNB1WNT3APDE10AMAPT | |
| SCHEMBL29703102 | 0.74 | PDE10A (0.48) | CYP2A6CTNNB1WNT3APDE10AMAPT | |
| SCHEMBL15087975 | 0.74 | CYP2A6 (0.38) | CA2CA12CYP2A6CTNNB1WNT3A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9318713-B2 | Asymmetric fused polyheteroaromatic compound, organic thin film including the asymmetric fused polyheteroaromatic compound, and electronic device including the organic thin film | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2016-04-19 | — | — | US | disclosed |
| US-20150133679-A1 | ASYMMETRIC FUSED POLYHETEROAROMATIC COMPOUND, ORGANIC THIN FILM INCLUDING THE ASYMMETRIC FUSED POLYHETEROAROMATIC COMPOUND, AND ELECTRONIC DEVICE INCLUDING THE ORGANIC THIN FILM | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2015-05-14 | — | — | US | disclosed |
| WO-2013060702-A1 | PHOTOLUMINESCENT COMPOUND OR MIXTURE OF PHOTOLUMINESCENT COMPOUNDS | ENI S.P.A. (IT) | 2013-05-02 | — | — | WO | disclosed |