Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.44 |
| ▸ | CDK9 | P50750 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | ACP3 | P15309 | 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 | |
|---|---|---|---|---|
| SCHEMBL915432 | 0.81 | NPSR1 (0.60) | NPSR1ATMTDP1CCNT1CDK9 | |
| SCHEMBL31688371 | 0.81 | NPSR1 (0.60) | NPSR1ATMTDP1CCNT1CDK9 | |
| SCHEMBL917312 | 0.80 | NPSR1 (0.78) | NPSR1ATMTDP1L3MBTL1GAA | |
| SCHEMBL31688370 | 0.80 | NPSR1 (0.78) | NPSR1ATMTDP1L3MBTL1GAA | |
| SCHEMBL5663746 | 0.78 | NPSR1 (0.60) | NPSR1ATMTDP1CCNT1CDK9 | |
| SCHEMBL7165895 | 0.75 | POLB (0.60) | NPSR1ATMTDP1CCNT1CDK9 | |
| SCHEMBL917313 | 0.74 | NPSR1 (0.46) | NPSR1ATML3MBTL1GAAKMT2A | |
| SCHEMBL1851484 | 0.74 | GRM8 (0.53) | NPSR1ATMTDP1CCNT1CDK9 | |
| SCHEMBL16146800 | 0.73 | TSHR (0.50) | NPSR1MAPTKMT2AMEN1CA1 | |
| Dinitrophenylene SCHEMBL28188292 | 0.73 | TSHR (0.55) | ATML3MBTL1MAPTKMT2AMEN1 |
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-8119617-B2 | aSMase inhibitors | NOVARTIS AG (CH) | 2012-02-21 | — | — | US | disclosed |