Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | GFER | P55789 | 1/20 | 0.32 |
| ▸ | PIM1 | P11309 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13116646 | 0.79 | MEN1 (0.34) | ALDH1A1NPSR1LMNAMEN1KMT2A | |
| SCHEMBL26669471 | 0.76 | HRH1 (0.36) | ALDH1A1NPSR1HRH1ADRB1USP2 | |
| Hydrochloric Acid SCHEMBL26600847 | 0.74 | ALDH1A1 (0.37) | ALDH1A1LMNAHRH1ADRB1USP2 | |
| SCHEMBL16302786 | 0.71 | ALDH1A1 (0.69) | ALDH1A1NPSR1LMNAMEN1KMT2A | |
| SCHEMBL11915954 | 0.69 | HPGD (0.42) | ALDH1A1NPSR1KMT2ATSHRKDM4E | |
| SCHEMBL2709516 | 0.65 | ALDH1A1 (0.45) | ALDH1A1NPSR1MEN1KMT2ATSHR | |
| SCHEMBL2711488 | 0.65 | ALDH1A1 (0.73) | ALDH1A1NPSR1LMNATSHRADRB1 | |
| Hydrochloric Acid SCHEMBL3570335 | 0.64 | ALDH1A1 (0.71) | ALDH1A1NPSR1LMNATSHRADRB1 | |
| SCHEMBL4412005 | 0.63 | ALDH1A1 (0.39) | ALDH1A1NPSR1LMNATSHRSMN1; SMN2 | |
| SCHEMBL10850393 | 0.63 | PLD1 (0.38) | ALDH1A1HRH1ADRB1USP2SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2010525-B1 | Diketo-piperazine and piperidine derivatives as antiviral agents | BRISTOL MYERS SQUIBB CO (US) | 2013-08-28 | — | — | EP | disclosed |