Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB3 | P13945 | 2/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 2/20 | 0.39 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.39 |
| ▸ | RET | P07949 | 1/20 | 0.39 |
| ▸ | KIF5B | P33176 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.39 |
| ▸ | CA3 | P07451 | 1/20 | 0.37 |
| ▸ | CA6 | P23280 | 1/20 | 0.37 |
| ▸ | CA5A | P35218 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6216871 | 0.81 | MAPT (0.41) | KDM4EMEN1CYP3A4MAPTCYP2C9 | |
| SCHEMBL1728733 | 0.75 | CA1 (0.47) | EGFRCA9CA14KDM4EMEN1 | |
| SCHEMBL241292 | 0.75 | MAPT (0.41) | RETKDM4EMEN1MAPTKMT2A | |
| SCHEMBL6908940 | 0.71 | ALDH1A1 (0.33) | MEN1MAPTKMT2A | |
| SCHEMBL6584102 | 0.70 | ALDH1A1 (0.44) | KDM4EMEN1MAPTALOX15KMT2A | |
| SCHEMBL19411103 | 0.69 | MAPT (0.38) | KDM4EMEN1CYP3A4MAPTCYP2C9 | |
| SCHEMBL10080364 | 0.68 | CA3 (0.45) | ADRB3ADRA2AADRA2BADRA2CADRB1 | |
| SCHEMBL484019 | 0.68 | GAA (0.48) | KDM4EMAPTALOX15KMT2A | |
| SCHEMBL11079274 | 0.68 | MAPT (0.58) | CYP3A4MAPTCYP2C9CYP2C19NPSR1 | |
| SCHEMBL19431843 | 0.68 | UTS2R (0.42) | KDM4EMEN1MAPTCYP2C9CYP2C19 |
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-1309551-A1 | INDOLINE DERIVATIVES AS 5HT2C ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 2003-05-14 | — | — | EP | disclosed |
| WO-2002014273-A1 | INDOLINE DERIVATIVES AS 5HT2C ANTAGONISTS | SMITHKLINE BEECHAM P.L.C. (GB) | 2002-02-21 | — | — | WO | disclosed |