Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 3/20 | 0.57 |
| ▸ | ACHE | P22303 | 3/20 | 0.57 |
| ▸ | BCHE | P06276 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | GAA | P10253 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | CTSS | P25774 | 2/20 | 0.48 |
| ▸ | CTSK | P43235 | 2/20 | 0.48 |
| ▸ | CTSL | P07711 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3292645 | 0.94 | APP (0.62) | APPACHEBCHEMAPTALDH1A1 | |
| SCHEMBL13325984 | 0.91 | CTSS (0.49) | APPACHEBCHEMAPTALDH1A1 | |
| SCHEMBL3290340 | 0.91 | CTSL (0.57) | APPACHEBCHEMAPTALDH1A1 | |
| SCHEMBL3287378 | 0.91 | CTSS (0.56) | ACHEALDH1A1KDM4ETDP1SMN1; SMN2 | |
| SCHEMBL13325957 | 0.89 | CTSS (0.54) | ACHEALDH1A1KDM4ETDP1SMN1; SMN2 | |
| SCHEMBL13326056 | 0.89 | ACHE (0.57) | APPACHEBCHEMAPTALDH1A1 | |
| SCHEMBL3293389 | 0.86 | SMN1; SMN2 (0.53) | MAPTALDH1A1GAATDP1SMN1; SMN2 | |
| SCHEMBL13326070 | 0.85 | PDE4A (0.53) | ACHEALDH1A1TDP1SMN1; SMN2CTSS | |
| SCHEMBL3287809 | 0.84 | CTSL (0.54) | MAPTALDH1A1KDM4ETDP1MEN1 | |
| SCHEMBL3289389 | 0.84 | CTSL (0.68) | MAPTALDH1A1TDP1MEN1KMT2A |
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-7718655-B2 | Trisubstituted triazine compounds, and methods for making and using the compounds, which have antitubulin activity | NEW YORK UNIVERSITY (US) | 2010-05-18 | — | — | US | disclosed |