Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIA2 | P42262 | 1/20 | 0.49 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.48 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | DRD1 | P21728 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HPGDS | O60760 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3658555 | 0.84 | GRIA2 (0.54) | GRIA2ENPP2KDM4ELMNAOPRM1 | |
| SCHEMBL2498139 | 0.84 | GRIA2 (0.54) | GRIA2ENPP2KDM4ELMNAOPRM1 | |
| SCHEMBL17211514 | 0.84 | GRIA2 (0.50) | GRIA2ENPP2DRD2DRD1TAAR1 | |
| SCHEMBL3654636 | 0.84 | GRIA2 (0.54) | GRIA2ENPP2KDM4ELMNAOPRM1 | |
| SCHEMBL24915424 | 0.83 | POLB (0.47) | TAAR1KDM4EKMT2AMAPTPARP1 | |
| SCHEMBL28662062 | 0.83 | ADRB2 (0.45) | — | |
| SCHEMBL9989813 | 0.81 | SLC1A1 (0.55) | TAAR1ALOX15PARP1 | |
| SCHEMBL933328 | 0.81 | CYP1A2 (0.47) | CYP1A2LMNAPMP22HIF1A | |
| SCHEMBL31324833 | 0.81 | PNMT (0.64) | TAAR1KDM4EPARP1CTBP2 | |
| SCHEMBL24709885 | 0.80 | ANPEP (0.59) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011006935-A2 | TETRAZOLE DERIVATIVES | MERCK SERONO S.A. (CH) | 2011-01-20 | — | — | WO | disclosed |