Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | GALR3 | O60755 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | PRF1 | P14222 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP3 | P08254 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MMP8 | P22894 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2087081 | 0.93 | PKM (0.40) | PKMPOLBPRF1MMP2MMP3 | |
| SCHEMBL620433 | 0.78 | THRB (0.51) | HTTLMNASMN1; SMN2GALR3RAB9A | |
| SCHEMBL28291689 | 0.74 | MMP2 (0.46) | LMNASMN1; SMN2RAB9AALDH1A1MEN1 | |
| SCHEMBL7059253 | 0.73 | PKM (0.39) | HTTLMNASMN1; SMN2ALDH1A1KMT2A | |
| SCHEMBL2089792 | 0.73 | CA2 (0.52) | PKM | |
| SCHEMBL21124780 | 0.72 | EDNRB (0.49) | LMNASMN1; SMN2RAB9AALDH1A1MEN1 | |
| SCHEMBL2088655 | 0.67 | PKM (0.38) | HTTLMNARAB9AMEN1KMT2A | |
| SCHEMBL1169197 | 0.66 | SMN1; SMN2 (0.47) | HTTLMNASMN1; SMN2GALR3RAB9A | |
| SCHEMBL21084036 | 0.64 | HPGD (0.44) | LMNASMN1; SMN2RAB9AMEN1KMT2A | |
| SCHEMBL7736172 | 0.64 | ALDH1A1 (0.39) | LMNASMN1; SMN2RAB9AALDH1A1MEN1 |
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-2227452-A2 | PYRIDINE COMPOUNDS | F. Hoffmann-La Roche AG (CH) | 2010-09-15 | — | — | EP | disclosed |
| WO-2009068468-A2 | PYRIDINE COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2009-06-04 | — | — | WO | disclosed |