Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 7/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | GART | P22102 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | XDH | P47989 | 1/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6475534 | 0.93 | SMN1; SMN2 (0.39) | CTSSSMN1; SMN2LMNAHTTGART | |
| SCHEMBL7045499 | 0.88 | ELANE (0.43) | XDHELANEMAPT | |
| SCHEMBL7047104 | 0.84 | LMNA (0.45) | CTSSSMN1; SMN2LMNAHTTGART | |
| SCHEMBL7046968 | 0.83 | ELANE (0.44) | SMN1; SMN2LMNAHTTXDHELANE | |
| SCHEMBL6464575 | 0.82 | LMNA (0.44) | SMN1; SMN2LMNAXDHALDH1A1POLB | |
| SCHEMBL7048562 | 0.81 | LMNA (0.48) | CTSSSMN1; SMN2LMNAHTTELANE | |
| SCHEMBL7048984 | 0.80 | KDM4E (0.40) | CTSSSMN1; SMN2LMNAHTTGART | |
| SCHEMBL7046461 | 0.80 | ELANE (0.43) | HTTXDHELANE | |
| SCHEMBL7181305 | 0.79 | LMNA (0.42) | CTSSLMNACYP3A4CYP2C9MAPT | |
| SCHEMBL6464414 | 0.78 | FAAH (0.38) | CTSSGARTXDHCYP3A4CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1516877-A1 | Amine derivatives as protease inhibitors | AXYS PHARMACEUTICALS, INC. (US) | 2005-03-23 | — | — | EP | disclosed |