Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.68 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.68 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.68 |
| ▸ | BLM | P54132 | 2/20 | 0.68 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.68 |
| ▸ | SMPD1 | P17405 | 2/20 | 0.66 |
| ▸ | MEN1 | O00255 | 2/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.63 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.59 |
| ▸ | BCHE | P06276 | 2/20 | 0.56 |
| ▸ | ACHE | P22303 | 2/20 | 0.56 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.54 |
| ▸ | HTR1A | P08908 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL10390463 | 0.91 | KDM4E (0.80) | KDM4ECYP1A2CYP3A4CYP2D6BLM | |
| SCHEMBL8790280 | 0.85 | KDM4E (0.58) | KDM4ECYP1A2CYP3A4CYP2D6BLM | |
| SCHEMBL514870 | 0.85 | KMT2A (0.82) | KDM4ECYP1A2CYP3A4CYP2D6BLM | |
| SCHEMBL8789796 | 0.83 | CYP1A2 (0.57) | KDM4ECYP1A2CYP3A4CYP2D6BLM | |
| SCHEMBL22186872 | 0.82 | CYP1A2 (0.68) | KDM4ECYP1A2CYP3A4CYP2D6BLM | |
| SCHEMBL8789870 | 0.82 | CYP19A1 (0.63) | KDM4ECYP1A2CYP3A4CYP2D6BLM | |
| SCHEMBL10526510 | 0.81 | EBP (0.68) | KDM4ESIGMAR1 | |
| SCHEMBL12971411 | 0.81 | EBP (0.68) | KDM4ESIGMAR1 | |
| SCHEMBL2325918 | 0.81 | L3MBTL1 (0.80) | KDM4ECYP1A2CYP3A4CYP2D6BLM | |
| SCHEMBL8791130 | 0.80 | ALDH1A1 (0.54) | KDM4ECYP1A2CYP3A4CYP2D6BLM |
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-2008081477-A1 | 3-ARYLOXY 3-SUBSTITUTED PROPANAMINES | NATCO PHARMA LIMITED (IN) | 2008-07-10 | — | — | WO | disclosed |