Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 11/20 | 0.41 |
| ▸ | ITGAV | P06756 | 11/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | STAT3 | P40763 | 1/20 | 0.38 |
| ▸ | STAT1 | P42224 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.36 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.36 |
| ▸ | ITGB6 | P18564 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL27524759 | 0.88 | ITGB3 (0.42) | ITGB3ITGAVCYP2D6CYP2C19CYP1A2 | |
| SCHEMBL27494528 | 0.86 | ITGB3 (0.45) | ITGB3ITGAVL3MBTL1ITGB1ITGB5 | |
| SCHEMBL27493347 | 0.84 | CYP2D6 (0.41) | ITGB3ITGAVCYP2D6CYP2C19SMN1; SMN2 | |
| SCHEMBL27494110 | 0.84 | CYP2D6 (0.41) | ITGB3ITGAVCYP2D6CYP2C19SMN1; SMN2 | |
| SCHEMBL27511354 | 0.84 | CYP2D6 (0.41) | ITGB3ITGAVCYP2D6CYP2C19SMN1; SMN2 | |
| SCHEMBL27509543 | 0.80 | MEN1 (0.41) | ITGB3ITGAVCYP2D6ITGA2BITGB1 | |
| SCHEMBL27510229 | 0.80 | SPR (0.46) | ITGB3ITGAVNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL27511699 | 0.80 | ITGB3 (0.52) | ITGB3ITGAVCYP2C19NPC1RAB9A | |
| SCHEMBL27510621 | 0.78 | ITGB3 (0.48) | ITGB3ITGAVCYP2D6CYP2C19NPC1 | |
| SCHEMBL27492956 | 0.76 | DRD2 (0.42) | ITGB3ITGAVCYP2C19NPC1RAB9A |
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-1223650-A | Piperidines and pyrrolidines | MERCK PATENT GMBH (DE) | 1999-07-21 | — | — | CN | disclosed |