Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.39 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | HTR4 | Q13639 | 2/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | TPMT | P51580 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.33 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.33 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.33 |
| ▸ | NNMT | P40261 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HTR3E | A5X5Y0 | 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 | |
|---|---|---|---|---|
| SCHEMBL4471890 | 0.87 | TPMT (0.42) | ALDH1A1KDM4EGAALMNAHSD17B10 | |
| SCHEMBL4474510 | 0.81 | TPMT (0.44) | ALDH1A1KDM4EGAAHTR4LMNA | |
| SCHEMBL4471489 | 0.79 | KDM4E (0.44) | ALDH1A1KDM4EGAAHTR4LMNA | |
| SCHEMBL8295684 | 0.78 | MAPK8 (0.43) | PARP1MAPK8KDM4EHTR4NPC1 | |
| SCHEMBL8295142 | 0.72 | KDM4E (0.65) | PARP1ALDH1A1KDM4ELMNAHSD17B10 | |
| SCHEMBL14776122 | 0.72 | ALDH1A1 (0.46) | ALDH1A1KDM4EGAAHTR4ACHE | |
| SCHEMBL13315460 | 0.71 | ALDH1A1 (0.41) | ALDH1A1KDM4EGAAHTR4LMNA | |
| SCHEMBL8296331 | 0.69 | ALDH1A1 (0.39) | MAPK8ALDH1A1KDM4EGAAHTR4 | |
| SCHEMBL10862772 | 0.68 | ACHE (0.43) | ALDH1A1KDM4EGAAHTR4ACHE | |
| SCHEMBL3628546 | 0.68 | GAA (0.42) | ALDH1A1KDM4EGAAHTR4ACHE |
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-1638959-B1 | 5HT -4 -ANTAGONISTIC 4-(AMINOMETHYL)-PIPERIDINE BENZAMIDES | JANSSEN PHARMACEUTICA NV (BE) | 2007-09-19 | — | — | EP | disclosed |
| WO-2005003122-A1 | 5HT4-ANTAGONISTIC 4-(AMINOMETHYL)-PIPERIDINE BENZAMIDES | JANSSEN PHARMACEUTICA N.V. (BE) | 2005-01-13 | — | — | WO | disclosed |