Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 11/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.47 |
| ▸ | CCR2 | P41597 | 1/20 | 0.47 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.39 |
| ▸ | PLK4 | O00444 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8038136 | 0.88 | SIGMAR1 (0.62) | CXCR4KMT2AMEN1CHRM2CHRM1 | |
| SCHEMBL4019574 | 0.84 | CXCR4 (0.52) | CXCR4KMT2AMEN1CHRM2CHRM1 | |
| SCHEMBL10574436 | 0.83 | ALDH1A1 (0.54) | TDP1LMNAALDH1A1 | |
| SCHEMBL8992842 | 0.82 | CXCR4 (0.41) | CXCR4KMT2AMEN1CHRM2CHRM1 | |
| SCHEMBL8715048 | 0.81 | CXCR4 (0.68) | CXCR4KMT2AMEN1CHRM2CHRM1 | |
| SCHEMBL14478352 | 0.80 | SIGMAR1 (0.53) | CXCR4KMT2AMEN1CHRM2CHRM1 | |
| SCHEMBL1578113 | 0.79 | SIGMAR1 (0.66) | CXCR4KMT2AMEN1CHRM2CHRM1 | |
| SCHEMBL14478353 | 0.75 | CXCR4 (0.57) | CXCR4KMT2AMEN1CHRM2CHRM1 | |
| SCHEMBL8993114 | 0.74 | KDM4E (0.39) | SIGMAR1ALDH1A1 | |
| SCHEMBL28434277 | 0.74 | SIGMAR1 (0.39) | SIGMAR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0292689-B1 | Substituted 1,4,7-triscarboxymethyl-1,4,7,10-tetraazacyclo-dodecane and analogs | BRACCO INT BV (NL) | 1996-07-31 | — | — | EP | claimed |
| US-4885363-A | RADIOPHARMACEUTICAL IMAGING; MEDICAL DIAGNOSIS | E. R. SQUIBB & SONS, INC. (US) | 1989-12-05 | — | — | US | claimed |
| EP-0292689-A2 | Substituted 1,4,7-triscarboxymethyl-1,4,7,10-tetraazacyclo-dodecane and analogs | BRACCO INTERNATIONAL B.V. (NL) | 1988-11-30 | — | — | EP | claimed |