Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10069342 | 0.92 | NPC1 (0.39) | NPC1RAB9ASMN1; SMN2CASP3SENP7 | |
| SCHEMBL24750118 | 0.81 | KDM4E (0.51) | NPC1RAB9ASMN1; SMN2CASP3SENP7 | |
| SCHEMBL30768370 | 0.81 | KDM4E (0.51) | NPC1RAB9ASMN1; SMN2CASP3SENP7 | |
| SCHEMBL10069323 | 0.81 | KDM4E (0.49) | NPC1RAB9ASMN1; SMN2CASP3SENP7 | |
| SCHEMBL24819230 | 0.79 | KDM4E (0.41) | NPC1RAB9ASMN1; SMN2CASP3SENP7 | |
| SCHEMBL10069355 | 0.78 | KDM4E (0.44) | NPC1RAB9ASMN1; SMN2CASP3SENP7 | |
| SCHEMBL31417799 | 0.77 | PTGS1 (0.38) | NPC1RAB9ASMN1; SMN2CASP3SENP7 | |
| SCHEMBL10069020 | 0.77 | ALDH1A1 (0.41) | NPC1RAB9ASMN1; SMN2CASP3SENP7 | |
| SCHEMBL31417516 | 0.77 | PTGS1 (0.38) | NPC1RAB9ASMN1; SMN2CASP3SENP7 | |
| SCHEMBL24750119 | 0.77 | EGFR (0.39) | NPC1RAB9ASMN1; SMN2CASP3SENP7 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012019428-A1 | BENZOHYDROL DERIVATIVES, A PREPARATION PROCESS AND PHARMACEUTICAL USE THEREOF | 上海恒瑞医药有限公司 (CN) | 2012-02-16 | — | — | WO | disclosed |