Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.42 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.42 |
| ▸ | KCNN4 | O15554 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1478852 | 0.87 | CYP1A2 (0.51) | KMT2AMAPTCYP2D6LMNACYP1A2 | |
| SCHEMBL6994278 | 0.85 | KMT2A (0.53) | KMT2AMAPTCYP2D6LMNACHRM2 | |
| SCHEMBL28020444 | 0.83 | MAPT (0.47) | KMT2AMAPTCYP2D6LMNACHRM2 | |
| SCHEMBL30412160 | 0.82 | ALDH1A1 (0.48) | KDM4EKIF11 | |
| SCHEMBL29730901 | 0.81 | MAPT (0.46) | KMT2AMAPTCYP2D6LMNACHRM2 | |
| SCHEMBL9295790 | 0.79 | CHRM3 (0.59) | KMT2AMAPTCYP2D6LMNACHRM2 | |
| SCHEMBL28150792 | 0.79 | HTT (0.56) | KMT2AMAPTCYP2D6LMNACHRM2 | |
| SCHEMBL19205720 | 0.79 | SCN5A (0.54) | KMT2AMAPTCYP2D6LMNACHRM2 | |
| SCHEMBL28906228 | 0.79 | ALDH1A1 (0.44) | KMT2AMAPTCYP2D6LMNACHRM2 | |
| SCHEMBL10885482 | 0.79 | MAPT (0.50) | KMT2AMAPTCYP2D6LMNACHRM2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1615915-A1 | PHENACYL 2-HYDROXY-3-DIAMINOALKANES | Elan Pharmaceuticals, Inc. (US) | 2006-01-18 | — | — | EP | disclosed |
| WO-2004094413-A1 | PHENACYL 2-HYDROXY-3-DIAMINOALKANES | ELAN PHARMACEUTICALS, INC. (US) | 2004-11-04 | — | — | WO | disclosed |