Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.38 |
| ▸ | ANPEP | P15144 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.37 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.37 |
| ▸ | METAP2 | P50579 | 1/20 | 0.36 |
| ▸ | METAP1 | P53582 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21891959 | 0.78 | POLB (0.44) | CYP1A2SIRT1ANPEPKMT2AGAA | |
| SCHEMBL5259541 | 0.77 | NPSR1 (0.53) | SLC1A3ALDH1A1GAA | |
| SCHEMBL1839387 | 0.77 | NPSR1 (0.53) | SLC1A3ALDH1A1GAA | |
| SCHEMBL24950560 | 0.74 | NPC1 (0.39) | CYP1A2SLC1A3NPC1RAB9ASIRT1 | |
| SCHEMBL21891811 | 0.73 | POLB (0.49) | CYP1A2SIRT1ANPEPFAAHKMT2A | |
| SCHEMBL21891858 | 0.72 | PPID (0.52) | CYP1A2ANPEPALDH1A1GAAPOLB | |
| SCHEMBL21891966 | 0.72 | POLB (0.42) | CYP1A2SIRT1GAAPOLBCYP3A4 | |
| SCHEMBL23130263 | 0.72 | POLB (0.58) | MEN1KMT2AALDH1A1LMNAPOLB | |
| SCHEMBL21891752 | 0.71 | MEN1 (0.39) | CYP1A2SLC1A3NPC1RAB9ASIRT1 | |
| SCHEMBL27830439 | 0.69 | BCL2 (0.57) | ANPEPKMT2AGAAPOLBCYP3A4 |
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-3626705-B1 | ISOCYANATE PRODUCTION METHOD | ASAHI CHEMICAL IND (JP) | 2021-03-24 | — | — | EP | disclosed |