Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 1/20 | 0.48 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | MMP2 | P08253 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GMNN | O75496 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL483020 | 1.00 | SHBG (0.48) | SHBGEPHX1TP53ALDH1A1HSD17B10 | |
| SCHEMBL3860192 | 1.00 | SHBG (0.48) | SHBGEPHX1TP53ALDH1A1HSD17B10 | |
| SCHEMBL466377 | 1.00 | SHBG (0.48) | SHBGEPHX1TP53ALDH1A1HSD17B10 | |
| Methane SCHEMBL11266020 | 0.97 | SHBG (0.46) | SHBGEPHX1TP53ALDH1A1HSD17B10 | |
| Ethane SCHEMBL11269854 | 0.97 | SHBG (0.46) | SHBGEPHX1TP53ALDH1A1HSD17B10 | |
| Ammonia Solution, Strong SCHEMBL7990121 | 0.97 | SHBG (0.46) | SHBGEPHX1TP53ALDH1A1HSD17B10 | |
| Ammonia Solution, Strong SCHEMBL6306401 | 0.97 | SHBG (0.46) | SHBGEPHX1TP53ALDH1A1HSD17B10 | |
| SCHEMBL3881590 | 0.96 | SHBG (0.43) | SHBGEPHX1TP53ALDH1A1HSD17B10 | |
| SCHEMBL9830140 | 0.93 | SHBG (0.41) | SHBGEPHX1TP53CA12CA1 | |
| SCHEMBL11043449 | 0.90 | SHBG (0.39) | SHBGEPHX1TP53CA12CA1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5670497-A | RETROVIRAL PROTEASE INHIBITORS | CIBA-GEIGY CORPORATION (US) | 1997-09-23 | — | — | US | disclosed |
| EP-0708760-A1 | CYCLIC HYDRAZINE COMPOUNDS | Novartis AG (CH) | 1996-05-01 | — | — | EP | disclosed |
| WO-1995002582-A1 | CYCLIC HYDRAZINE COMPOUNDS | CIBA-GEIGY AG (CH) | 1995-01-26 | — | — | WO | disclosed |