Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR3 | P29371 | 3/20 | 0.75 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.69 |
| ▸ | LMNA | P02545 | 5/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.65 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.65 |
| ▸ | TP53 | P04637 | 3/20 | 0.64 |
| ▸ | HPGD | P15428 | 2/20 | 0.64 |
| ▸ | HTT | P42858 | 2/20 | 0.64 |
| ▸ | NPC1 | O15118 | 1/20 | 0.64 |
| ▸ | RAB9A | P51151 | 1/20 | 0.64 |
| ▸ | MEN1 | O00255 | 1/20 | 0.62 |
| ▸ | POLB | P06746 | 1/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.62 |
| ▸ | TSHR | P16473 | 1/20 | 0.62 |
| ▸ | TACR2 | P21452 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL6448423 | 0.92 | TACR3 (0.70) | TACR3CYP2C9LMNAALDH1A1KDM4E | |
| SCHEMBL6450086 | 0.86 | TACR3 (1.00) | TACR3CYP2C9LMNAALDH1A1KDM4E | |
| SCHEMBL4466010 | 0.84 | LMNA (0.67) | TACR3CYP2C9LMNAALDH1A1KDM4E | |
| SCHEMBL6451780 | 0.84 | TACR3 (0.69) | TACR3CYP2C9LMNAALDH1A1KDM4E | |
| SCHEMBL4464898 | 0.83 | LMNA (0.73) | TACR3CYP2C9LMNAALDH1A1KDM4E | |
| SCHEMBL5049690 | 0.82 | TACR3 (0.70) | TACR3LMNAALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL14623959 | 0.82 | TACR3 (0.72) | TACR3LMNAALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL10391576 | 0.81 | TACR3 (0.76) | TACR3LMNAALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL28806102 | 0.81 | TACR3 (0.83) | TACR3CYP2C9LMNAALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL6969107 | 0.80 | TACR3 (0.71) | TACR3LMNAALDH1A1KDM4ESMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1517708-A1 | COMBINATION TREATMENT FOR DEPRESSION AND ANXIETY BY NK1 AND NK3 ANTAGONISTS | Pfizer Products Inc. (US) | 2005-03-30 | — | — | EP | claimed |
| WO-2004000355-A1 | COMBINATION TREATMENT FOR DEPRESSION AND ANXIETY BY NK1 AND NK3 ANTAGONISTS | PFIZER PRODUCTS INC. (US) | 2003-12-31 | — | — | WO | claimed |