Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 6/20 | 0.41 |
| ▸ | CA1 | P00915 | 6/20 | 0.41 |
| ▸ | CA9 | Q16790 | 6/20 | 0.41 |
| ▸ | CA2 | P00918 | 4/20 | 0.41 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | MMP8 | P22894 | 1/20 | 0.33 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.32 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | GSDMD | P57764 | 1/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.32 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20315917 | 0.78 | CA12 (0.39) | ALDH1A1ALDH2CA12CA1CA9 | |
| SCHEMBL3073635 | 0.76 | GRIN2D (0.40) | ALDH1A1ALDH2CA12CA1CA9 | |
| SCHEMBL13955312 | 0.73 | CA12 (0.41) | ALDH1A1ALDH2CA12CA1CA9 | |
| SCHEMBL28947901 | 0.72 | ALDH1A1 (0.56) | ALDH1A1ALDH2CA12CA1CA9 | |
| SCHEMBL244470 | 0.72 | ALDH1A1 (0.56) | ALDH1A1ALDH2CA12CA1CA9 | |
| SCHEMBL28417961 | 0.72 | CA12 (0.41) | ALDH1A1ALDH2CA12CA1CA9 | |
| SCHEMBL28415126 | 0.72 | CA12 (0.41) | ALDH1A1ALDH2CA12CA1CA9 | |
| SCHEMBL9871360 | 0.71 | ALDH1A1 (0.61) | ALDH1A1ALDH2CA12CA1CA9 | |
| SCHEMBL10591900 | 0.71 | CA1 (0.40) | ALDH1A1ALDH2CA12CA1CA9 | |
| SCHEMBL2955338 | 0.71 | CA12 (0.39) | ALDH1A1ALDH2CA12CA1CA9 |
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-1472319-A1 | NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT | UNIVERSITY OF DAYTON (US) | 2004-11-03 | — | — | EP | disclosed |
| WO-2003060019-A1 | NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT | UNIVERSITY OF DAYTON (US) | 2003-07-24 | — | — | WO | disclosed |