Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 5/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.36 |
| ▸ | PRMT5 | O14744 | 2/20 | 0.35 |
| ▸ | WDR77 | Q9BQA1 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | UGT8 | Q16880 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8560245 | 0.88 | ALDH1A1 (0.43) | ALDH1A1KDM4ETDP1USP2ALOX15 | |
| SCHEMBL5555201 | 0.84 | ALDH1A1 (0.42) | ALDH1A1KDM4ETDP1USP2ALOX15 | |
| SCHEMBL5557277 | 0.83 | ALDH1A1 (0.46) | ALDH1A1KDM4ETDP1USP2ALOX15 | |
| SCHEMBL5551312 | 0.82 | KDM4E (0.43) | ALDH1A1KDM4ETDP1USP2ALOX15 | |
| SCHEMBL5551517 | 0.81 | ALDH1A1 (0.45) | ALDH1A1KDM4ETDP1USP2ALOX15 | |
| SCHEMBL8302334 | 0.80 | PIK3CD (0.38) | ALOX15L3MBTL1HTTLMNATSHR | |
| SCHEMBL8481805 | 0.79 | ALDH1A1 (0.48) | ALDH1A1KDM4ETDP1USP2ALOX15 | |
| SCHEMBL8927900 | 0.78 | KMT2A (0.42) | MEN1KMT2AHTTLMNA | |
| SCHEMBL5551332 | 0.78 | ALDH1A1 (0.42) | ALDH1A1KDM4ETDP1USP2ALOX15 | |
| SCHEMBL8482314 | 0.77 | ALDH1A1 (0.38) | ALDH1A1KDM4EUSP2ALOX15MEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0700392-B1 | USE OF MACROCYCLIC METAL COMPLEXES AS TEMPERATURE PROBES | SCHERING AG (DE) | 1998-12-09 | — | — | EP | disclosed |
| US-5747000-A | 1,4-7-TRIS-(CARBOXYMETHYL)-1,4,7,10-TETRAAZACYCLODODECANE DERIVATIVES; DETERMINING CHEMICAL SHIFT OF SIGNALS IN NUCLEAR MAGNETIC RESONANCE | SCHERING AKTIENGESELLSCHAFT (DE) | 1998-05-05 | — | — | US | disclosed |
| EP-0700392-A1 | USE OF MACROCYCLIC METAL COMPLEXES AS TEMPERATURE PROBES | SCHERING AKTIENGESELLSCHAFT (DE) | 1996-03-13 | — | — | EP | disclosed |
| WO-1994027977-A1 | USE OF MACROCYCLIC METAL COMPLEXES AS TEMPERATURE PROBES | SCHERING AKTIENGESELLSCHAFT (DE) | 1994-12-08 | — | — | WO | disclosed |