Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | TBXAS1 | P24557 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HMOX2 | P30519 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | CYP24A1 | Q07973 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27709358 | 0.79 | ALDH1A1 (0.46) | ALDH1A1KDM4EEGLN3CYP19A1TBXAS1 | |
| SCHEMBL28801348 | 0.75 | KDM4E (0.43) | ALDH1A1KDM4EEGLN3CYP19A1KMT2A | |
| Hydrochloric Acid SCHEMBL28804726 | 0.74 | KDM4E (0.43) | ALDH1A1KDM4EEGLN3CYP19A1TBXAS1 | |
| Hydrochloric Acid SCHEMBL28339290 | 0.73 | TBXAS1 (0.40) | ALDH1A1KDM4EEGLN3CYP19A1TBXAS1 | |
| SCHEMBL29256166 | 0.73 | ALDH1A1 (0.40) | ALDH1A1KDM4EEGLN3CYP19A1KMT2A | |
| SCHEMBL27839878 | 0.73 | CYP17A1 (0.43) | ALDH1A1KDM4EEGLN3CYP19A1TBXAS1 | |
| SCHEMBL72311 | 0.72 | — | — | |
| SCHEMBL2400948 | 0.71 | KDM4E (0.40) | ALDH1A1KDM4EEGLN3CYP19A1TBXAS1 | |
| SCHEMBL6983161 | 0.71 | CYP24A1 (0.56) | KDM4ECYP19A1HMOX2TDP1CYP24A1 | |
| Hydrochloric Acid SCHEMBL9020718 | 0.71 | CYP17A1 (0.42) | CYP19A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2978772-A1 | BETA-HAIRPIN PEPTIDOMIMETICS | Polyphor AG (CH) | 2016-02-03 | — | — | EP | disclosed |
| EP-2978771-A1 | BETA-HAIRPIN PEPTIDOMIMETICS | Polyphor Ag (CH) | 2016-02-03 | — | — | EP | disclosed |
| WO-2014161782-A1 | BETA-HAIRPIN PEPTIDOMIMETICS | POLYPHOR AG (CH) | 2014-10-09 | — | — | WO | disclosed |
| WO-2014161781-A1 | BETA-HAIRPIN PEPTIDOMIMETICS | POLYPHOR AG (CH) | 2014-10-09 | — | — | WO | disclosed |