Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.48 |
| ▸ | TPMT | P51580 | 1/20 | 0.46 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.44 |
| ▸ | GRM4 | Q14833 | 2/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.39 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.38 |
| ▸ | GMNN | O75496 | 1/20 | 0.38 |
| ▸ | HTR3B | O95264 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.38 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | GRN | P28799 | 1/20 | 0.38 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL349820 | 0.87 | PARP1 (0.60) | PARP1TPMTHTR3EHTR3BTSHR | |
| Hydrochloric Acid SCHEMBL4371939 | 0.84 | PARP1 (0.58) | PARP1TPMTHTR3EHTR3BTSHR | |
| SCHEMBL2260587 | 0.83 | NOTUM (0.45) | PARP1SMYD3MEN1KMT2ACNR1 | |
| SCHEMBL14060424 | 0.82 | PARP1 (0.56) | PARP1TPMTP2RX7HTR3EHTR3B | |
| SCHEMBL5048829 | 0.82 | PARP1 (0.60) | PARP1TPMTTSHRPMP22HSD17B10 | |
| SCHEMBL4339312 | 0.74 | HCAR1 (0.65) | PARP1TPMTTSHRPMP22HSD17B10 | |
| SCHEMBL1363329 | 0.72 | PARP1 (0.50) | PARP1TPMTTSHRMEN1KMT2A | |
| SCHEMBL22383502 | 0.72 | PARP1 (0.50) | PARP1TPMTADRA1DMAP4K4HCAR1 | |
| SCHEMBL30463182 | 0.72 | PARP1 (0.50) | PARP1TPMTADRA1DMAP4K4HCAR1 | |
| SCHEMBL9631667 | 0.72 | PARP1 (0.50) | PARP1TPMTADRA1DMAP4K4HCAR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105130953-A | Benzamide compound and preparation method thereof | JIANGXI ANLIDA CHEMICAL CO LTD | 2015-12-09 | — | — | CN | disclosed |