Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | PPIB | P23284 | 1/20 | 0.46 |
| ▸ | PPIA | P62937 | 1/20 | 0.46 |
| ▸ | PPID | Q08752 | 1/20 | 0.46 |
| ▸ | PPIG | Q13427 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | F10 | P00742 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | RORC | P51449 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14020494 | 0.87 | CA2 (0.58) | ALDH1A1KMT2ASMN1; SMN2LMNACA2 | |
| SCHEMBL14375791 | 0.84 | MAPT (0.47) | ALDH1A1KMT2ASMN1; SMN2CA2POLB | |
| SCHEMBL3147669 | 0.80 | PPID (0.50) | ALDH1A1PPIBPPIAPPIDPPIG | |
| SCHEMBL23703543 | 0.78 | TP53 (0.51) | ALDH1A1KMT2ASMN1; SMN2MEN1CA2 | |
| SCHEMBL7227133 | 0.76 | PPID (0.47) | ALDH1A1PPIBPPIAPPIDPPIG | |
| SCHEMBL13480882 | 0.75 | CA12 (0.43) | ALDH1A1KMT2ASMN1; SMN2LMNACYP1A2 | |
| SCHEMBL5229900 | 0.74 | KMT2A (0.47) | ALDH1A1KMT2ASMN1; SMN2CA2F10 | |
| SCHEMBL4671375 | 0.73 | SMN1; SMN2 (0.51) | ALDH1A1KMT2ASMN1; SMN2LMNAPOLB | |
| SCHEMBL14095588 | 0.72 | CA1 (0.55) | ALDH1A1KMT2ASMN1; SMN2LMNACYP1A2 | |
| SCHEMBL4673511 | 0.72 | POLB (0.51) | ALDH1A1KMT2ASMN1; SMN2LMNAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105693597-A | New inhibitors of cyclophilins and uses thereof | 国家健康与医学研究院（INSERM） | 2016-06-22 | — | — | CN | disclosed |
| CN-102811998-B | Novel cyclophilin inhibitors and uses thereof | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) | 2016-03-30 | — | — | CN | disclosed |