Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | ACACB | O00763 | 3/20 | 0.46 |
| ▸ | ACACA | Q13085 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL11210081 | 1.00 | KMT2A (0.58) | KMT2ALMNAMAPK1PARP10ALDH1A1 | |
| SCHEMBL10378871 | 0.87 | CYP1A2 (0.61) | LMNAMAPK1NPSR1GAABLM | |
| SCHEMBL10378872 | 0.87 | CYP1A2 (0.61) | LMNAMAPK1NPSR1GAABLM | |
| SCHEMBL21501376 | 0.86 | AKR1C3 (0.55) | KMT2ALMNAALDH1A1NPSR1BLM | |
| SCHEMBL11002192 | 0.82 | KMT2A (0.60) | KMT2ALMNAPARP10ALDH1A1CNR2 | |
| SCHEMBL27579668 | 0.82 | KMT2A (0.60) | KMT2ALMNAPARP10ALDH1A1CNR2 | |
| SCHEMBL6396086 | 0.80 | PTGS1 (0.53) | KMT2ALMNAMAPK1ALDH1A1NPSR1 | |
| SCHEMBL6402645 | 0.80 | PTGS1 (0.53) | KMT2ALMNAMAPK1ALDH1A1NPSR1 | |
| SCHEMBL6396089 | 0.80 | PTGS1 (0.53) | KMT2ALMNAMAPK1ALDH1A1NPSR1 | |
| SCHEMBL4634271 | 0.80 | TSHR (0.56) | LMNAMAPK1ALDH1A1NPSR1BLM |
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-0033583-B1 | DYESTUFFS COMPRISING TWO 5-MEMBERED HETEROCYCLIC NUCLEI FUSED TO A CENTRAL CYCLOHEXADIENE NUCLEUS, PROCESSES FOR THEIR PREPARATION AND THEIR USE FOR COLOURING SYNTHETIC TEXTILE MATERIALS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1983-10-12 | — | — | EP | disclosed |
| EP-0033583-A1 | Dyestuffs comprising two 5-membered heterocyclic nuclei fused to a central cyclohexadiene nucleus, processes for their preparation and their use for colouring synthetic textile materials | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1981-08-12 | — | — | EP | disclosed |