Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | GABRP | O00591 | 1/20 | 0.32 |
| ▸ | GABRD | O14764 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14830864 | 0.89 | MT-CO2 (0.38) | ALDH1A1KDM4EGAAMT-CO2SMN1; SMN2 | |
| SCHEMBL14830160 | 0.80 | KDM4E (0.41) | ALDH1A1KDM4EGAATSHRTDP1 | |
| SCHEMBL5879111 | 0.77 | S1PR1 (0.35) | ALDH1A1TSHRMT-CO2L3MBTL1 | |
| SCHEMBL3229659 | 0.76 | RAB9A (0.32) | ALDH1A1TSHRL3MBTL1 | |
| SCHEMBL31679532 | 0.74 | SMN1; SMN2 (0.43) | ALDH1A1KDM4EGAATSHRNPSR1 | |
| SCHEMBL3846164 | 0.73 | L3MBTL1 (0.31) | TSHRL3MBTL1 | |
| SCHEMBL3219458 | 0.73 | GPBAR1 (0.34) | ALDH1A1TSHRL3MBTL1 | |
| SCHEMBL3221801 | 0.73 | POLB (0.40) | ALDH1A1KDM4EGAATSHRTDP1 | |
| SCHEMBL15466723 | 0.73 | SSTR4 (0.35) | ALDH1A1KDM4EGAATSHRNPSR1 | |
| SCHEMBL22798736 | 0.73 | NCEH1 (0.34) | KDM4ESMN1; SMN2L3MBTL1 |
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-2760845-A1 | HETEROCYCLIC COMPOUNDS AS MDM2 INHIBITORS FOR THE TREATMENT OF CANCER | Amgen Inc. (US) | 2014-08-06 | — | — | EP | disclosed |
| WO-2013049250-A1 | HETEROCYCLIC COMPOUNDS AS MDM2 INHIBITORS FOR THE TREATMENT OF CANCER | AMGEN INC. (US) | 2013-04-04 | — | — | WO | disclosed |