Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 5/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | NOS1 | P29475 | 4/20 | 0.45 |
| ▸ | NOS3 | P29474 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.44 |
| ▸ | CDK1 | P06493 | 3/20 | 0.44 |
| ▸ | CDK4 | P11802 | 3/20 | 0.44 |
| ▸ | CCND1 | P24385 | 3/20 | 0.44 |
| ▸ | CDK2 | P24941 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9564803 | 0.90 | NOS2 (0.46) | NOS2ALDH1A1KDM4EHSD17B10SMN1; SMN2 | |
| SCHEMBL9698789 | 0.90 | NOS2 (0.59) | NOS2ALDH1A1KDM4EHSD17B10SMN1; SMN2 | |
| SCHEMBL9564864 | 0.89 | ALDH1A1 (0.51) | NOS2ALDH1A1KDM4EHSD17B10SMN1; SMN2 | |
| SCHEMBL9698868 | 0.85 | NOS2 (0.60) | NOS2ALDH1A1KDM4EHSD17B10SMN1; SMN2 | |
| SCHEMBL9564948 | 0.85 | ALDH1A1 (0.42) | NOS2ALDH1A1KDM4EHSD17B10SMN1; SMN2 | |
| SCHEMBL9630380 | 0.84 | NOS2 (0.52) | NOS2ALDH1A1KDM4EHSD17B10SMN1; SMN2 | |
| SCHEMBL9564816 | 0.84 | NOS2 (0.46) | NOS2ALDH1A1KDM4EHSD17B10SMN1; SMN2 | |
| SCHEMBL9564849 | 0.84 | SMN1; SMN2 (0.50) | NOS2ALDH1A1KDM4EHSD17B10SMN1; SMN2 | |
| SCHEMBL9564902 | 0.84 | USP2 (0.51) | NOS2ALDH1A1KDM4EHSD17B10SMN1; SMN2 | |
| SCHEMBL9565029 | 0.83 | ALDH1A1 (0.51) | NOS2ALDH1A1KDM4EHSD17B10SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0206415-B1 | (4-PIPERIDINYLMETHYL AND -HETERO)PURINES | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-01-27 | — | — | EP | disclosed |
| US-5041448-A | Antiallergens | JANSSEN PHARMACEUTICA N.V. (BE) | 1991-08-20 | — | — | US | disclosed |
| EP-0206415-A2 | (4-Piperidinylmethyl and -hetero)purines | JANSSEN PHARMACEUTICA N.V. (BE) | 1986-12-30 | — | — | EP | disclosed |