Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.62 |
| ▸ | ABCB1 | P08183 | 9/20 | 0.60 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.56 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.56 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.56 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.56 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.56 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.56 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.56 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.56 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.56 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.56 |
| ▸ | HTR2A | P28223 | 1/20 | 0.56 |
| ▸ | HTR2C | P28335 | 1/20 | 0.56 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.56 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL10968562 | 0.85 | POLB (0.59) | POLBABCB1LMNACYP1A2CYP2D6 | |
| SCHEMBL7372331 | 0.82 | POLB (0.56) | POLBABCB1LMNACYP1A2CYP2D6 | |
| SCHEMBL7363941 | 0.81 | POLB (0.55) | POLBABCB1LMNACYP1A2CYP2D6 | |
| SCHEMBL11180904 | 0.80 | ABCB1 (0.66) | POLBABCB1LMNASMN1; SMN2TP53 | |
| SCHEMBL22639704 | 0.78 | POLB (0.98) | POLBABCB1LMNAADRB2ADRB1 | |
| SCHEMBL22639942 | 0.78 | POLB (0.98) | POLBABCB1LMNAADRB2ADRB1 | |
| SCHEMBL16727483 | 0.77 | ABCB1 (0.75) | POLBABCB1LMNAADRB2ADRB1 | |
| SCHEMBL8781936 | 0.76 | NR2E1 (0.71) | ABCB1LMNACYP1A2CYP2D6SLC22A1 | |
| SCHEMBL3339926 | 0.76 | ABCB1 (0.64) | POLBABCB1LMNASMN1; SMN2TP53 | |
| SCHEMBL10876890 | 0.76 | ABCB1 (0.57) | ABCB1LMNACYP1A2CYP2D6CYP3A4 |
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-8323911-B2 | High throughput assay for discovering new inhibitors of the GIRK1/4 channel | UNIVERSITY OF SOUTH CAROLINA (US) | 2012-12-04 | — | — | US | disclosed |
| US-20110281278-A1 | High Throughput Assay for Discovering New Inhibitors of the GIRK1/4 Channel | UNIVERSITY OF SOUTH CAROLINA (US) | 2011-11-17 | — | — | US | disclosed |