Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | ELANE | P08246 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | CTRC | Q99895 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | RAD52 | P43351 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.36 |
| ▸ | TLR8 | Q9NR97 | 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 | |
|---|---|---|---|---|
| SCHEMBL9304750 | 0.81 | CTRC (0.45) | KMT2AMEN1ELANEHTR2ACTRC | |
| SCHEMBL6275934 | 0.80 | MTNR1A (0.38) | MTNR1AMTNR1B | |
| SCHEMBL318001 | 0.73 | DHODH (0.46) | ELANEMTNR1AMTNR1BSMN1; SMN2TP53 | |
| SCHEMBL9307145 | 0.72 | MTNR1A (0.42) | KMT2AMEN1ELANEMTNR1AMTNR1B | |
| SCHEMBL6489417 | 0.72 | ELANE (0.41) | ELANECYP1A2 | |
| SCHEMBL1637201 | 0.70 | CTRC (0.43) | KMT2AMEN1HTR2ACTRCGPR55 | |
| SCHEMBL9304178 | 0.68 | ACHE (0.43) | KMT2AMEN1CYP1A2NPSR1GAA | |
| SCHEMBL5043562 | 0.68 | PSMB8 (0.56) | ELANESMN1; SMN2CYP1A2 | |
| SCHEMBL20982326 | 0.68 | ALOX5 (0.51) | KMT2AMEN1HTR2ACTRCGPR55 | |
| SCHEMBL9303940 | 0.68 | ALDH1A1 (0.47) | KMT2AMEN1ELANESMN1; SMN2CYP1A2 |
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-5347008-A | Thio(cyclo) alkanepolycarboxylic acids containing heterocyclic substituents | CIBA-GEIGY CORPORATION (US) | 1994-09-13 | — | — | US | disclosed |
| EP-0129506-A2 | Heterocyclically substituted thio(cyclo)alkane polycarboxylic acids | CIBA-GEIGY AG (CH) | 1984-12-27 | — | — | EP | disclosed |