Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR3 | P29371 | 7/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | TACR2 | P21452 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | MTOR | P42345 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL7457296 | 0.89 | SMN1; SMN2 (0.39) | GAATSHRSMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL25366914 | 0.81 | TACR3 (0.59) | TACR3GAATSHRCYP1A2CYP3A4 | |
| SCHEMBL7452543 | 0.81 | LMNA (0.44) | GAASMN1; SMN2LMNAALDH1A1PRSS1 | |
| SCHEMBL7448758 | 0.80 | KMT2A (0.39) | MAPK1LMNAALDH1A1KMT2ANPSR1 | |
| SCHEMBL7446916 | 0.79 | HDAC1 (0.50) | MAPK1KDM4EMEN1KMT2ANPSR1 | |
| SCHEMBL305032 | 0.78 | L3MBTL1 (0.45) | SMN1; SMN2CYP1A2LMNAALDH1A1KDM4E | |
| SCHEMBL30065221 | 0.78 | L3MBTL1 (0.45) | SMN1; SMN2CYP1A2LMNAALDH1A1KDM4E | |
| SCHEMBL594359 | 0.78 | L3MBTL1 (0.45) | SMN1; SMN2CYP1A2LMNAALDH1A1KDM4E | |
| SCHEMBL6398159 | 0.78 | ERAP2 (0.42) | — | |
| SCHEMBL8157657 | 0.77 | TACR3 (0.50) | TACR3GAATSHRSMN1; SMN2CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001027096-A9 | AMINOMETHYL-(HETERO)ARYL DERIVATIVES AND THEIR USE AS TRYPTASE INHIBITORS | PROTHERICS MOLECULAR DESIGN LT (GB) | 2001-07-12 | — | — | WO | disclosed |
| WO-2001027096-A1 | AMINOMETHYL-(HETERO)ARYL DERIVATIVES AND THEIR USE AS TRYPTASE INHIBITORS | TULARIK LIMITED (GB) | 2001-04-19 | — | — | WO | disclosed |