Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.33 |
| ▸ | CHRNA6 | Q15825 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13823190 | 0.66 | NAAA (0.57) | ALDH1A1NPC1TP53RAB9ACYP2C19 | |
| SCHEMBL673711 | 0.62 | — | — | |
| SCHEMBL18485413 | 0.61 | ALDH1A1 (0.50) | ALDH1A1TSHRMEN1KMT2APOLB | |
| SCHEMBL5004246 | 0.60 | CHRNB2 (0.37) | ALDH1A1NPC1TP53RAB9ACYP2C19 | |
| SCHEMBL18485449 | 0.60 | CES1 (0.47) | ALDH1A1CYP2C19MAPTCYP1A2CHRNB2 | |
| SCHEMBL10941068 | 0.60 | SMN1; SMN2 (0.55) | NPC1MAPTTSHRMEN1KMT2A | |
| SCHEMBL6176681 | 0.60 | CES1 (0.40) | CYP2C19CYP3A4MAPTTSHRCYP2C9 | |
| SCHEMBL14229140 | 0.60 | NOTUM (0.50) | ALDH1A1NPC1CYP2C19CYP3A4CYP1A2 | |
| SCHEMBL6173745 | 0.60 | CES1 (0.40) | CYP2C19CYP3A4MAPTTSHRCYP2C9 | |
| SCHEMBL4297881 | 0.58 | CHRNB2 (0.38) | CYP2C19CYP3A4MAPTTSHRCYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105209038-B | Osteopontin with dictyostelium discoideum pyrone derivative or dihydro dictyostelium discoideum pyrone derivative as active ingredient produces inhibitor | 国立大学法人东北大学 | 2017-06-09 | — | — | CN | disclosed |