Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.37 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.37 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 5/20 | 0.37 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.36 |
| ▸ | STAT3 | P40763 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4193036 | 0.80 | TAS1R3 (0.61) | NPC1RAB9ATAS1R3TAS1R1TAS1R2 | |
| SCHEMBL13929093 | 0.80 | TAS1R3 (0.61) | NPC1RAB9ATAS1R3TAS1R1TAS1R2 | |
| SCHEMBL5748022 | 0.72 | CNR2 (0.48) | P2RX7NTRK1JAK2 | |
| SCHEMBL8313049 | 0.71 | TAS1R3 (0.53) | NPC1RAB9ATAS1R3TAS1R1TAS1R2 | |
| SCHEMBL6063490 | 0.71 | PDE4B (0.65) | NPC1RAB9ATAS1R3TAS1R1TAS1R2 | |
| SCHEMBL8353433 | 0.71 | PDE4B (0.65) | NPC1RAB9ATAS1R3TAS1R1TAS1R2 | |
| SCHEMBL4971162 | 0.70 | RAB9A (0.51) | NPC1RAB9AKDM4ELMNAHTT | |
| SCHEMBL3174715 | 0.67 | NPC1 (0.58) | NPC1RAB9AKDM4ELMNAHPGD | |
| SCHEMBL6897684 | 0.67 | CTSL (0.40) | P2RX7 | |
| SCHEMBL6063810 | 0.67 | PDE4A (0.50) | NPC1RAB9ATAS1R3TAS1R1TAS1R2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6949573-B2 | Nicotinamide derivatives useful as PDE4 inhibitors | PFIZER INC (US) | 2005-09-27 | — | — | US | disclosed |