Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.68 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.68 |
| ▸ | TSHR | P16473 | 1/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.58 |
| ▸ | MEN1 | O00255 | 3/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.58 |
| ▸ | RECQL | P46063 | 1/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | GALR3 | O60755 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL2981646 | 0.80 | SMN1; SMN2 (0.68) | SMN1; SMN2MAPK1TSHRALDH1A1KMT2A | |
| SCHEMBL7492632 | 0.79 | MEN1 (0.57) | SMN1; SMN2MAPK1TSHRALDH1A1KMT2A | |
| SCHEMBL1163936 | 0.78 | SMN1; SMN2 (0.66) | SMN1; SMN2MAPK1TSHRALDH1A1KMT2A | |
| SCHEMBL3158236 | 0.77 | SMN1; SMN2 (0.58) | SMN1; SMN2MAPK1TSHRALDH1A1KMT2A | |
| SCHEMBL4427998 | 0.75 | SMN1; SMN2 (0.55) | SMN1; SMN2MAPK1TSHRALDH1A1KMT2A | |
| SCHEMBL12846045 | 0.75 | SMN1; SMN2 (0.62) | SMN1; SMN2MAPK1TSHRALDH1A1KMT2A | |
| SCHEMBL29222827 | 0.75 | SMN1; SMN2 (0.61) | SMN1; SMN2MAPK1TSHRALDH1A1KMT2A | |
| SCHEMBL1164483 | 0.75 | SMN1; SMN2 (0.61) | SMN1; SMN2MAPK1TSHRALDH1A1KMT2A | |
| SCHEMBL2982271 | 0.74 | SMN1; SMN2 (0.54) | SMN1; SMN2MAPK1TSHRALDH1A1KMT2A | |
| SCHEMBL24254327 | 0.74 | HPGD (0.58) | SMN1; SMN2MAPK1TSHRALDH1A1KMT2A |
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-9757375-B2 | Compounds that inhibit human DNA ligases and methods of treating cancer | UNIVERSITY OF MARYLAND, BALTIMORE (US) | 2017-09-12 | — | — | US | disclosed |