Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSTO1 | P78417 | 1/20 | 0.40 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.36 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.36 |
| ▸ | CACNB1 | Q02641 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20199872 | 0.93 | DRD4 (0.42) | GSTO1KDM4ELMNAALDH1A1TSHR | |
| Tromethamine SCHEMBL9264448 | 0.88 | GSTO1 (0.38) | GSTO1USP30KDM4ENPC1LMNA | |
| SCHEMBL9079855 | 0.80 | HPGD (0.38) | NPC1LMNARAB9AALDH1A1CHRM2 | |
| SCHEMBL9080751 | 0.80 | BACE1 (0.40) | USP30KDM4ENPC1LMNARAB9A | |
| SCHEMBL1387733 | 0.78 | ALDH1A1 (0.43) | KDM4ENPC1LMNARAB9AALDH1A1 | |
| SCHEMBL9079184 | 0.77 | MEN1 (0.41) | KDM4ENPC1RAB9ACHRM2CHRM4 | |
| SCHEMBL20187483 | 0.77 | CTSL (0.46) | KDM4EALDH1A1CHRM2CHRM4CHRM1 | |
| SCHEMBL9080067 | 0.76 | ALDH1A1 (0.42) | KDM4ENPC1LMNARAB9AALDH1A1 | |
| SCHEMBL9079737 | 0.76 | HPGD (0.40) | KDM4ENPC1LMNARAB9AALDH1A1 | |
| SCHEMBL9298715 | 0.73 | SMN1; SMN2 (0.45) | GSTO1ALDH1A1TSHRMEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5573752-A | Aromatic amide compounds and metal chelates thereof | BRACCO INTERNATIONAL B.V. | 1996-11-12 | — | — | US | disclosed |