Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL11272766 | 0.89 | ALDH1A1 (0.50) | ALDH1A1ALOX15KDM4ECA12CA1 | |
| SCHEMBL6234867 | 0.84 | ALDH1A1 (0.45) | ALDH1A1ALOX15KDM4ECA12CA1 | |
| SCHEMBL11414000 | 0.79 | ALDH1A1 (0.46) | ALDH1A1ALOX15KDM4ECA12CA1 | |
| SCHEMBL9171525 | 0.79 | ALDH1A1 (0.46) | ALDH1A1ALOX15KDM4ECA12CA1 | |
| SCHEMBL7833396 | 0.79 | ALDH1A1 (0.46) | ALDH1A1ALOX15KDM4ECA12CA1 | |
| SCHEMBL233478 | 0.78 | ALDH1A1 (0.45) | ALDH1A1KDM4ECA12CA9KMT2A | |
| SCHEMBL2573164 | 0.75 | ALDH1A1 (0.56) | ALDH1A1ALOX15KDM4ECA12CA1 | |
| SCHEMBL30828909 | 0.75 | ALDH1A1 (0.56) | ALDH1A1ALOX15KDM4ECA12CA1 | |
| SCHEMBL8179330 | 0.75 | ALDH1A1 (0.42) | ALDH1A1ALOX15KDM4ECA12CA1 | |
| SCHEMBL9134133 | 0.74 | ALDH1A1 (0.54) | ALDH1A1ALOX15KDM4ECA12CA1 |
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-1100778-A1 | OXIDISED SULFURATED DISTAMYCIN DERIVATIVES, PROCESS FOR PREPARING THEM, AND THEIR USE AS ANTITUMOR AGENTS | PHARMACIA & UPJOHN S.p.A. (IT) | 2001-05-23 | — | — | EP | disclosed |
| WO-2000006542-A1 | OXIDISED SULFURATED DISTAMYCIN DERIVATIVES, PROCESS FOR PREPARING THEM, AND THEIR USE AS ANTITUMOR AGENTS | PHARMACIA & UPJOHN S.P.A. (IT) | 2000-02-10 | — | — | WO | disclosed |