Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | IKBKB | O14920 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 5/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8218893 | 0.90 | NAMPT (0.37) | LMNAALDH1A1IKBKBRAB9ANAMPT | |
| SCHEMBL8199078 | 0.88 | HTR1A (0.42) | LMNAIKBKBHTTSMN1; SMN2NAMPT | |
| SCHEMBL8195918 | 0.86 | IKBKB (0.37) | LMNAALDH1A1IKBKBHTTSMN1; SMN2 | |
| SCHEMBL8198968 | 0.81 | IKBKB (0.44) | LMNAALDH1A1IKBKBRAB9AL3MBTL1 | |
| SCHEMBL8195688 | 0.80 | IKBKB (0.43) | LMNAALDH1A1IKBKBRAB9AL3MBTL1 | |
| SCHEMBL8196333 | 0.79 | ADRB2 (0.36) | LMNAHTTNAMPTHTR1AADRA1D | |
| SCHEMBL8196331 | 0.79 | ADRB2 (0.36) | LMNAHTTNAMPTHTR1AADRA1D | |
| SCHEMBL8200614 | 0.79 | IKBKB (0.38) | LMNAALDH1A1IKBKBRAB9AL3MBTL1 | |
| SCHEMBL8195627 | 0.78 | IKBKB (0.46) | LMNAALDH1A1IKBKBRAB9AL3MBTL1 | |
| SCHEMBL8195700 | 0.77 | KCNA3 (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000061561-A1 | CYANOGUANIDINE COMPOUNDS | SHIONOGI BIORESEARCH CORP. (US) | 2000-10-19 | — | — | WO | claimed |
| WO-2000061561-A1 | CYANOGUANIDINE COMPOUNDS | SHIONOGI BIORESEARCH CORP. (US) | 2000-10-19 | — | — | WO | disclosed |