Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 8/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.49 |
| ▸ | RAB9A | P51151 | 4/20 | 0.49 |
| ▸ | GLA | P06280 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.49 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 5/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28275985 | 0.86 | KMT2A (0.55) | KMT2AALDH1A1KDM4ERAB9AGLA | |
| SCHEMBL4014126 | 0.84 | KMT2A (0.64) | KMT2AALDH1A1KDM4ERAB9AGLA | |
| SCHEMBL28318100 | 0.84 | ALDH1A1 (0.53) | KMT2AALDH1A1KDM4ERAB9AGLA | |
| SCHEMBL1187275 | 0.79 | ALDH1A1 (0.58) | KMT2AALDH1A1KDM4ERAB9AGLA | |
| SCHEMBL28265823 | 0.78 | ALDH1A1 (0.53) | KMT2AALDH1A1KDM4ERAB9AGLA | |
| SCHEMBL1187919 | 0.78 | ALDH1A1 (0.56) | KMT2AALDH1A1KDM4ERAB9AGLA | |
| SCHEMBL31517086 | 0.77 | CYP1A2 (0.45) | KMT2AALDH1A1KDM4EHPGDGAA | |
| SCHEMBL3101185 | 0.77 | CYP1A2 (0.45) | KMT2AALDH1A1KDM4EHPGDGAA | |
| SCHEMBL5707682 | 0.76 | ALDH1A1 (0.46) | KMT2AALDH1A1KDM4ERAB9AGLA | |
| SCHEMBL28917948 | 0.76 | ALDH1A1 (0.55) | KMT2AALDH1A1KDM4ERAB9AGLA |
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-6630481-B2 | Phototherapeutic and catalytic photoactivated DNA cleaving agents | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH OF INDIA (IN) | 2003-10-07 | — | — | US | claimed |