Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.30 |
| ▸ | PRKCG | P05129 | 1/20 | 0.30 |
| ▸ | PRKCB | P05771 | 1/20 | 0.30 |
| ▸ | PRKCA | P17252 | 1/20 | 0.30 |
| ▸ | PRKCH | P24723 | 1/20 | 0.30 |
| ▸ | PRKCI | P41743 | 1/20 | 0.30 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.30 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.30 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.30 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.30 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8528821 | 0.91 | TSHR (0.42) | ACE2LMNAMEN1CYP3A4ALOX15 | |
| SCHEMBL10412583 | 0.89 | ACE2 (0.38) | ACE2LMNAMEN1CYP3A4ALOX15 | |
| SCHEMBL1739698 | 0.83 | MEN1 (0.33) | LMNAMEN1CYP3A4ALOX15KMT2A | |
| SCHEMBL20530410 | 0.83 | ACE2 (0.39) | ACE2LMNAMEN1CYP3A4ALOX15 | |
| SCHEMBL1971850 | 0.82 | TSHR (0.40) | MEN1CYP3A4ALOX15KMT2ATSHR | |
| SCHEMBL9490940 | 0.81 | MEN1 (0.32) | LMNAMEN1CYP3A4ALOX15KMT2A | |
| SCHEMBL306062 | 0.81 | LMNA (0.48) | ACE2LMNAMEN1CYP3A4ALOX15 | |
| SCHEMBL20509870 | 0.80 | LMNA (0.40) | ACE2LMNAMEN1CYP3A4ALOX15 | |
| SCHEMBL4977384 | 0.79 | LMNA (0.53) | ACE2LMNATSHRPRKD3PRKCG | |
| SCHEMBL1970647 | 0.78 | MEN1 (0.37) | ACE2LMNAMEN1CYP3A4ALOX15 |
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-6995265-B2 | Synthesis of nicotine derivatives from nicotine | NORTH CAROLINA STATE UNIVERSITY (US) | 2006-02-07 | — | — | US | disclosed |