Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.34 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 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 | |
|---|---|---|---|---|
| SCHEMBL1764282 | 0.81 | ALDH1A1 (0.47) | ALDH1A1KDM4ESMN1; SMN2LMNASRD5A2 | |
| SCHEMBL15943729 | 0.78 | ALDH1A1 (0.47) | ALDH1A1KDM4ESMN1; SMN2LMNASRD5A2 | |
| SCHEMBL3997292 | 0.77 | ALDH1A1 (0.43) | ALDH1A1LMNASRD5A2MEN1NPC1 | |
| SCHEMBL12132313 | 0.76 | ALDH1A1 (0.52) | ALDH1A1KDM4ESMN1; SMN2LMNASRD5A2 | |
| SCHEMBL6136486 | 0.74 | HPGD (0.58) | ALDH1A1CNR1CNR2KEAP1NFE2L2 | |
| SCHEMBL6136490 | 0.74 | HPGD (0.58) | ALDH1A1CNR1CNR2KEAP1NFE2L2 | |
| SCHEMBL5083378 | 0.74 | RAB9A (0.39) | SMN1; SMN2LMNAMEN1NPC1RAB9A | |
| SCHEMBL10811517 | 0.72 | CXCL8 (0.66) | ALDH1A1KDM4ESMN1; SMN2LMNACNR1 | |
| SCHEMBL10811793 | 0.72 | CXCL8 (0.66) | ALDH1A1KDM4ESMN1; SMN2LMNACNR1 | |
| SCHEMBL8595859 | 0.71 | ALDH1A1 (0.46) | ALDH1A1KDM4ESMN1; SMN2LMNASRD5A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1082304-A1 | NEW CRYSTALLINE POLYMORPHIC FORM OF 1-METHYL-5-p-TOLUOYLPYRROLE-2-ACETAMIDOACETIC ACID GUAIACYL ESTER (MED 15) | Sigma-Tau Industrie Farmaceutiche Riunite S.p.A. (IT) | 2001-03-14 | — | — | EP | claimed |
| WO-1999033797-A1 | NEW CRYSTALLINE POLYMORPHIC FORM OF 1-METHYL-5-p-TOLUOYLPYRROLE-2-ACETAMIDOACETIC ACID GUAIACYL ESTER (MED 15) | SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) | 1999-07-08 | — | — | WO | claimed |