Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 2/20 | 0.72 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.54 |
| ▸ | KMO | O15229 | 1/20 | 0.53 |
| ▸ | DHODH | Q02127 | 6/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 1/20 | 0.45 |
| ▸ | TDO2 | P48775 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29106079 | 0.85 | LDHA (0.63) | LDHAKDM4ELMNASMN1; SMN2PDE10A | |
| SCHEMBL8874883 | 0.84 | KMO (0.57) | LDHAKDM4ELMNASMN1; SMN2KMO | |
| SCHEMBL2026675 | 0.84 | LDHA (0.61) | LDHAKDM4ELMNASMN1; SMN2PDE10A | |
| SCHEMBL13328090 | 0.83 | LDHA (0.48) | LDHAKDM4ELMNASMN1; SMN2PDE10A | |
| SCHEMBL29908929 | 0.82 | LDHA (0.64) | LDHAKDM4ELMNASMN1; SMN2PDE10A | |
| SCHEMBL11680709 | 0.81 | MCL1 (0.60) | LDHAKDM4ELMNASMN1; SMN2DHODH | |
| SCHEMBL32682873 | 0.80 | LDHA (0.65) | LDHAKDM4ELMNASMN1; SMN2PDE10A | |
| Nitrous Acid SCHEMBL28887145 | 0.79 | LDHA (0.55) | LDHAKDM4ELMNASMN1; SMN2PDE10A | |
| SCHEMBL17162947 | 0.77 | LDHA (0.57) | LDHAKDM4ELMNASMN1; SMN2PDE10A | |
| SCHEMBL8502219 | 0.75 | SMN1; SMN2 (0.63) | LDHAKDM4ELMNASMN1; SMN2PDE10A |
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-5621027-A | Dyestuffs for bulk dyeing plastics | BAYER AKTIENGESELLSCHAFT (DE) | 1997-04-15 | — | — | US | disclosed |
| EP-0683212-A1 | New dyes for the bulk dyeing of synthetic materials | BAYER AG (DE) | 1995-11-22 | — | — | EP | disclosed |