Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 4/20 | 0.55 |
| ▸ | MTOR | P42345 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MITF | O75030 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CCR6 | P51684 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 5/20 | 0.36 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL9736535 | 0.82 | NPC1 (0.46) | PLK1MTORSMN1; SMN2ALDH1A1TDP1 | |
| SCHEMBL5173548 | 0.74 | PLK1 (0.71) | PLK1MTORCYP3A4SMN1; SMN2ALDH1A1 | |
| SCHEMBL19742292 | 0.71 | NPC1 (0.43) | PLK1MTORSMN1; SMN2ALDH1A1TDP1 | |
| SCHEMBL5171474 | 0.71 | PLK1 (1.00) | PLK1MTORCYP3A4ALDH1A1TDP1 | |
| Cyclapolin 9 SCHEMBL5055142 | 0.71 | PLK1 (1.00) | PLK1MTORCYP3A4ALDH1A1TDP1 | |
| SCHEMBL29653627 | 0.71 | PLK1 (1.00) | PLK1MTORCYP3A4ALDH1A1TDP1 | |
| SCHEMBL10441742 | 0.69 | ALDH1A1 (0.42) | CYP3A4SMN1; SMN2ALDH1A1GPR35TDP1 | |
| SCHEMBL19742250 | 0.69 | PLK1 (0.43) | PLK1MTORCYP3A4SMN1; SMN2ALDH1A1 | |
| Cyclapolin 1 SCHEMBL5062617 | 0.69 | PLK1 (1.00) | PLK1MTORCYP3A4CYP1A2CYP2D6 | |
| SCHEMBL27597666 | 0.66 | ALDH1A1 (0.56) | CYP3A4SMN1; SMN2ALDH1A1GPR35TDP1 |
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-5096910-A | For plants | BAYER AKTIENGESELLSCHAFT (DE) | 1992-03-17 | — | — | US | disclosed |