Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STAT3 | P40763 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | LDHA | P00338 | 1/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL15236787 | 0.80 | STAT3 (0.73) | STAT3CA2LDHACYP3A4ABCB1 | |
| SCHEMBL318036 | 0.79 | CA2 (0.68) | STAT3ALDH1A1CA2LDHACYP3A4 | |
| SCHEMBL29475007 | 0.79 | CA2 (0.68) | STAT3ALDH1A1CA2LDHACYP3A4 | |
| SCHEMBL7959717 | 0.78 | CA2 (0.57) | STAT3ALDH1A1CA2TSHRHTT | |
| SCHEMBL15259646 | 0.78 | CALM1 (0.50) | ALDH1A1CA2TSHRKDM4E | |
| SCHEMBL31512861 | 0.77 | FOS (0.58) | ALDH1A1TSHRALOX15ALOX12ADRB2 | |
| SCHEMBL580129 | 0.77 | FOS (0.58) | ALDH1A1TSHRALOX15ALOX12ADRB2 | |
| SCHEMBL21402273 | 0.77 | ALOX15 (0.58) | TSHRALOX15ALOX12LMNACYP3A4 | |
| SCHEMBL4387213 | 0.76 | ALDH1A1 (0.42) | STAT3ALDH1A1CA2TSHRHTT | |
| SCHEMBL4598867 | 0.76 | LDHA (0.64) | STAT3ALDH1A1CA2HTTALOX15 |
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 |