Known targets — ChEMBL curated mechanism
GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQ
The experimentally established mechanism targets of Water. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 1/20 | 0.60 |
| ▸ | THRB | P10828 | 1/20 | 0.60 |
| ▸ | HTT | P42858 | 1/20 | 0.60 |
| ▸ | RECQL | P46063 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.60 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.60 |
| ▸ | RXRA | P19793 | 1/20 | 0.33 |
| ▸ | RXRB | P28702 | 1/20 | 0.33 |
| ▸ | RXRG | P48443 | 1/20 | 0.33 |
| ▸ | SNCA | P37840 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 3/20 | 0.32 |
| ▸ | CA2 | P00918 | 3/20 | 0.32 |
| ▸ | CA12 | O43570 | 2/20 | 0.32 |
| ▸ | CA7 | P43166 | 2/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1367336 | 0.99 | LMNA (0.61) | LMNAMEN1MAPTTHRBHTT | |
| SCHEMBL10093777 | 0.86 | LMNA (0.46) | LMNAMEN1MAPTTHRBHTT | |
| SCHEMBL41357 | 0.85 | LMNA (0.63) | LMNAMEN1MAPTTHRBHTT | |
| SCHEMBL7750107 | 0.85 | MAPT (0.46) | LMNAMEN1MAPTTHRBHTT | |
| SCHEMBL559594 | 0.83 | MEN1 (0.43) | LMNAMEN1MAPTTHRBHTT | |
| SCHEMBL12830842 | 0.83 | LMNA (0.43) | LMNAMEN1MAPTTHRBHTT | |
| SCHEMBL12267581 | 0.83 | MEN1 (0.43) | LMNAMEN1MAPTTHRBHTT | |
| SCHEMBL11685506 | 0.83 | MAPT (0.54) | LMNAMEN1MAPTTHRBHTT | |
| SCHEMBL7750539 | 0.82 | KMT2A (0.43) | LMNAMEN1MAPTTHRBHTT | |
| SCHEMBL4966820 | 0.82 | MEN1 (0.43) | LMNAMEN1MAPTTHRBHTT |
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-6734310-B2 | A CYANINE DYE, WITH A COMBINATION OF SULPHOARYL GROUPS, ALKYL SUBSTITUENTS IN THE MESO POSITION OF THE METHINE CHAIN AND AT LEAST ONE REACTIVE GROUP WHICH PERMITS BINDING TO BIOMOLECULES. | FEW CHEMICALS GMBH (DE) | 2004-05-11 | — | — | US | disclosed |
| US-20030135058-A1 | Flurescent marker | FEW CHEMICALS GMBH (DE) | 2003-07-17 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20030135058-A1 | Flurescent marker | MYADM, CCL2, CD14 | LMNA 4076/4885MEN1 1576/4885MAPT 3427/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.