Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.36 |
| ▸ | CA2 | P00918 | 6/20 | 0.36 |
| ▸ | CA1 | P00915 | 5/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | FDPS | P14324 | 1/20 | 0.33 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL5281509 | 0.93 | SMPD1 (0.44) | ALDH1A1SMPD1CA2CA1CA12 | |
| SCHEMBL5278349 | 0.91 | SMPD1 (0.47) | SMPD1CA2CA1CA12CA7 | |
| SCHEMBL5273914 | 0.91 | SMPD1 (0.47) | SMPD1CA2CA1CA12CA7 | |
| SCHEMBL3825698 | 0.85 | ALDH1A1 (0.43) | ALDH1A1CA2CA1CA12CA7 | |
| SCHEMBL10671319 | 0.84 | ALDH1A1 (0.32) | ALDH1A1SMPD1 | |
| SCHEMBL28036004 | 0.82 | ALDH1A1 (0.37) | ALDH1A1CA2CA1CA12CA7 | |
| SCHEMBL4438455 | 0.79 | ALDH1A1 (0.44) | ALDH1A1CA2CA1TP53TSHR | |
| SCHEMBL29110583 | 0.79 | ALDH1A1 (0.39) | ALDH1A1CA2CA1TP53TSHR | |
| SCHEMBL905471 | 0.79 | ALDH1A1 (0.44) | ALDH1A1CA2CA1TP53TSHR | |
| SCHEMBL3526721 | 0.77 | TP53 (0.41) | ALDH1A1CA2CA1CA12CA7 |
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-0429932-A2 | Photographic material | Agfa-Gevaert AG (DE) | 1991-06-05 | — | — | EP | disclosed |
| EP-0269440-A1 | Multicolor heat-sensitive recording material | Fuji Photo Film Co., Ltd. (JP) | 1988-06-01 | — | — | EP | disclosed |