Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 2/20 | 0.40 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.40 |
| ▸ | CDK1 | P06493 | 1/20 | 0.40 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.40 |
| ▸ | GSK3A | P49840 | 1/20 | 0.40 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8541143 | 0.75 | MAPK1 (0.51) | ALDH1A1NPSR1GSK3BCCNB2CDK1 | |
| SCHEMBL8541098 | 0.75 | TDP1 (0.47) | GSK3BCCNB2CDK1CCNB1GSK3A | |
| SCHEMBL8542469 | 0.75 | TSHR (0.49) | ALDH1A1NPSR1GSK3BCCNB2CDK1 | |
| SCHEMBL14906663 | 0.74 | ALDH1A1 (0.52) | ALDH1A1NPSR1KMT2AMEN1HTT | |
| SCHEMBL27729686 | 0.73 | NISCH (0.51) | ALDH1A1POLBSMN1; SMN2CYP2C19 | |
| SCHEMBL31658933 | 0.72 | S100A4 (0.44) | GSK3BCCNB2CDK1CCNB1GSK3A | |
| SCHEMBL17059593 | 0.72 | ALDH1A1 (0.50) | ALDH1A1NPSR1KMT2AMEN1HTT | |
| SCHEMBL10680334 | 0.70 | MAPT (0.39) | ALDH1A1GSK3BCCNB2CDK1CCNB1 | |
| SCHEMBL8540558 | 0.69 | VCAM1 (0.46) | GSK3BCCNB2CDK1CCNB1GSK3A | |
| SCHEMBL1303527 | 0.69 | CSNK1A1 (0.50) | ALDH1A1KMT2AMEN1SMN1; SMN2ACHE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5162318-A | Which have pulmonary surfactant secretion promoting activity | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1992-11-10 | — | — | US | disclosed |
| EP-0454330-A1 | Benzimidazolinone derivatives | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1991-10-30 | — | — | EP | disclosed |