Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | HRH2 | P25021 | 2/20 | 0.32 |
| ▸ | HRH1 | P35367 | 2/20 | 0.32 |
| ▸ | HTR6 | P50406 | 2/20 | 0.32 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 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 | |
|---|---|---|---|---|
| SCHEMBL14164372 | 0.84 | HTR6 (0.37) | CYP1A2CYP2D6HRH4KDM4ENPC1 | |
| SCHEMBL29413193 | 0.79 | MEN1 (0.32) | CYP1A2CYP2D6HRH4KDM4ENPC1 | |
| SCHEMBL214039 | 0.73 | IDO1 (0.38) | HRH4KDM4EALDH1A1LMNAMAPT | |
| SCHEMBL30518953 | 0.67 | DRD2 (0.38) | HRH4KDM4EALDH1A1LMNAHRH2 | |
| SCHEMBL29438383 | 0.65 | MAOA (0.45) | KDM4ENPC1ALDH1A1LMNAGAA | |
| SCHEMBL667761 | 0.65 | MAOA (0.45) | KDM4ENPC1ALDH1A1LMNAGAA | |
| SCHEMBL15549945 | 0.65 | KDM4E (0.36) | CYP1A2CYP2D6HRH4KDM4ENPC1 | |
| SCHEMBL29870245 | 0.65 | CYP1A2 (0.41) | CYP1A2CYP2D6HRH4KDM4ENPC1 | |
| SCHEMBL5438463 | 0.63 | HDAC3 (0.61) | CYP1A2CYP2D6HRH4HDAC3HDAC1 | |
| SCHEMBL2059873 | 0.63 | KDM4E (0.32) | CYP1A2CYP2D6KDM4ENPC1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2591355-A2 | IN VITRO POINT-OF-CARE SENSOR AND METHOD OF USE | CASE WESTERN RESERVE UNIVERSITY (US) | 2013-05-15 | — | — | EP | disclosed |
| WO-2012021239-A9 | IN VITRO POINT-OF-CARE SENSOR AND METHOD OF USE | CASE WESTERN RESERVE UNIVERSITY (US) | 2012-05-31 | — | — | WO | disclosed |
| WO-2012021239-A2 | IN VITRO POINT-OF-CARE SENSOR AND METHOD OF USE | CASE WESTERN RESERVE UNIVERSITY (US) | 2012-02-16 | — | — | WO | disclosed |