Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | GBA1 | P04062 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | BLM | P54132 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12643708 | 0.84 | TSHR (0.52) | KMT2ATSHRMAPK1 | |
| SCHEMBL21993827 | 0.84 | TSHR (0.52) | KMT2ATSHRMAPK1 | |
| SCHEMBL8668385 | 0.82 | KMT2A (0.38) | CYP2C19KMT2ATSHR | |
| SCHEMBL2804427 | 0.76 | CYP2D6 (0.45) | CYP2C19KDM4EMAPTMEN1KMT2A | |
| SCHEMBL10469586 | 0.76 | MEN1 (0.58) | CYP2C19KDM4EMAPTMEN1KMT2A | |
| SCHEMBL20835887 | 0.74 | CYP2C19 (0.50) | CYP2C19MEN1KMT2ACYP2D6LMNA | |
| SCHEMBL8668280 | 0.72 | CYP2C19 (0.42) | CYP2C19MEN1KMT2ACYP2D6LMNA | |
| SCHEMBL8954371 | 0.71 | CYP2D6 (0.39) | CYP2C19KDM4EMAPTMEN1KMT2A | |
| SCHEMBL8666859 | 0.71 | CYP2D6 (0.39) | CYP2C19KDM4EMAPTMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL5550665 | 0.70 | KDM4E (0.40) | CYP2C19KDM4EMAPTHIF1AGBA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5707991-A | TREATMENT OF NERVOUS SYSTEM DISORDERS, PARKINSON'S DISEASE | RHONE-POULENC RORER S.A. (FR) | 1998-01-13 | — | — | US | disclosed |