Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | POLB | P06746 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.42 |
| ▸ | MEN1 | O00255 | 5/20 | 0.42 |
| ▸ | HTT | P42858 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.40 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28026971 | 0.91 | LMNA (0.47) | LMNAALDH1A1POLBHPGDL3MBTL1 | |
| SCHEMBL28027599 | 0.91 | LMNA (0.47) | LMNAALDH1A1HPGDRAB9ASMN1; SMN2 | |
| SCHEMBL28027600 | 0.83 | LMNA (0.53) | LMNAALDH1A1POLBRAB9ASMN1; SMN2 | |
| SCHEMBL7567444 | 0.81 | SMN1; SMN2 (0.51) | ALDH1A1HPGDL3MBTL1NPC1RAB9A | |
| SCHEMBL8415723 | 0.77 | HTT (0.54) | LMNASMN1; SMN2KMT2AMEN1HTT | |
| SCHEMBL27929178 | 0.76 | ALDH1A1 (0.52) | LMNAALDH1A1POLBHPGDL3MBTL1 | |
| SCHEMBL9181012 | 0.70 | KMT2A (0.54) | LMNAALDH1A1POLBHPGDNPC1 | |
| SCHEMBL8898123 | 0.70 | KMT2A (0.54) | LMNAALDH1A1POLBHPGDNPC1 | |
| SCHEMBL8576836 | 0.68 | MMP9 (0.53) | KMT2AMEN1HTT | |
| SCHEMBL6917355 | 0.68 | MMP9 (0.53) | KMT2AMEN1HTT |
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 |
|---|---|---|---|---|---|---|---|
| CN-103408465-B | A kind of N-disubstituted benzenes ylmethyl valine amide carbamate derivatives and application | NANKAI UNIVERSITY (CN) | 2015-08-26 | — | — | CN | claimed |