Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 6/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.43 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | RAD52 | P43351 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2124479 | 0.87 | CYP19A1 (0.64) | CYP19A1MAPTALDH1A1RAB9ANPC1 | |
| SCHEMBL2124481 | 0.87 | CYP19A1 (0.64) | CYP19A1MAPTALDH1A1RAB9ANPC1 | |
| SCHEMBL2125127 | 0.83 | CYP19A1 (0.50) | CYP19A1MAPTALDH1A1RAB9ANPC1 | |
| SCHEMBL2125852 | 0.81 | CYP19A1 (0.56) | CYP19A1MAPTALDH1A1RAB9ANPC1 | |
| SCHEMBL2124014 | 0.79 | CYP19A1 (0.59) | CYP19A1MAPTALDH1A1RAB9ANPC1 | |
| SCHEMBL2126096 | 0.76 | CYP19A1 (0.57) | CYP19A1MAPTALDH1A1RAB9ANPC1 | |
| SCHEMBL2125130 | 0.74 | CYP19A1 (0.48) | CYP19A1MAPTALDH1A1RAB9ANPC1 | |
| SCHEMBL27829894 | 0.73 | CYP19A1 (0.55) | CYP19A1MAPTALDH1A1RAB9ANPC1 | |
| SCHEMBL2123393 | 0.72 | CYP19A1 (0.57) | CYP19A1MAPTALDH1A1RAB9ANPC1 | |
| SCHEMBL2419185 | 0.72 | CYP19A1 (0.69) | CYP19A1MAPTALDH1A1RAB9ANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2444392-A1 | (Aza)indole derivative substituted in position 5, pharmaceutical composition comprising it, intermediate compounds and preparation process therefor | Aziende Chimiche Riunite Angelini Francesco A.C.R.A.F. S.p.A. (IT) | 2012-04-25 | — | — | EP | disclosed |