Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 6/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | ATR | Q13535 | 1/20 | 0.35 |
| ▸ | STK17B | O94768 | 1/20 | 0.35 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.35 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1192179 | 0.86 | ATR (0.42) | GAANPC1RAB9AKMT2AMEN1 | |
| SCHEMBL30065454 | 0.86 | ATR (0.42) | GAANPC1RAB9AKMT2AMEN1 | |
| SCHEMBL27797732 | 0.85 | ALDH1A1 (0.46) | GAAKMT2AMEN1ALDH1A1SMN1; SMN2 | |
| SCHEMBL27874209 | 0.78 | ALDH1A1 (0.65) | GAANPC1RAB9AKMT2AMEN1 | |
| SCHEMBL27871459 | 0.77 | GAA (0.40) | GAAKMT2AMEN1ALDH1A1SMN1; SMN2 | |
| SCHEMBL27841455 | 0.77 | GAA (0.51) | GAANPC1RAB9AKMT2AMEN1 | |
| SCHEMBL15758463 | 0.74 | RAB9A (0.46) | GAANPC1RAB9AKMT2AMEN1 | |
| SCHEMBL30737870 | 0.74 | SCN9A (0.36) | GAANPC1RAB9AKMT2AMEN1 | |
| SCHEMBL8190552 | 0.73 | NPC1 (0.60) | GAANPC1RAB9AKMT2AMEN1 | |
| SCHEMBL2035708 | 0.73 | GRM4 (0.43) | NPC1RAB9AALDH1A1SMN1; SMN2MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-103339110-A | Substituted hetero-biaryl compounds as CDK9 inhibitors and uses thereof | NOVARTIS AG | 2013-10-02 | — | — | CN | disclosed |
| CN-102471310-A | Bipyridines useful for the treatment of proliferative diseases | NOVARTIS AG | 2012-05-23 | — | — | CN | disclosed |