Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 2/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | CDK4 | P11802 | 1/20 | 0.34 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.34 |
| ▸ | CCND1 | P24385 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | CCND3 | P30281 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | RAC1 | P63000 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.33 |
| ▸ | ABCG2 | Q9UNQ0 | 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 | |
|---|---|---|---|---|
| SCHEMBL16282199 | 0.85 | MAPT (0.39) | CYP2A6KDRRAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL16282214 | 0.81 | TSHR (0.40) | CYP2A6KDRTSHRTP53MAPT | |
| SCHEMBL13024054 | 0.80 | CYP2A6 (0.46) | CYP2A6CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8051257 | 0.79 | KDM4E (0.35) | CYP2A6TSHRTP53RELASMN1; SMN2 | |
| SCHEMBL17740540 | 0.79 | ALDH1A1 (0.39) | CYP2A6ALOX5NPC1RAB9AABCG2 | |
| SCHEMBL17999996 | 0.78 | SLC16A3 (0.42) | CYP2A6NPC1TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL12888150 | 0.78 | KDM4E (0.34) | CYP2A6TSHRTP53RELASMN1; SMN2 | |
| SCHEMBL557550 | 0.77 | CYP2A6 (0.45) | CYP2A6ALOX5ESR1ESR2SIRT2 | |
| SCHEMBL12019896 | 0.77 | RXRA (0.36) | ESR1ESR2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL12019775 | 0.77 | RXRA (0.36) | ESR1ESR2CYP1A2CYP3A4CYP2D6 |
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-20160233428-A1 | ORGANIC LIGHT-EMITTING DEVICE | SAMSUNG DISPLAY CO., LTD. (KR) | 2016-08-11 | — | — | US | disclosed |
| US-20160233428-A1 | ORGANIC LIGHT-EMITTING DEVICE | SAMSUNG DISPLAY CO., LTD. (KR) | 2016-08-11 | — | — | US | disclosed |