Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B | P41595 | 3/20 | 0.49 |
| ▸ | GUSB | P08236 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | MGAM | O43451 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | SI | P14410 | 1/20 | 0.41 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.41 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL21091032 | 0.80 | ALDH1A1 (0.51) | GAAHPGDMEN1NPC1MAPT | |
| SCHEMBL1207261 | 0.78 | ALDH1A1 (0.52) | MGAMGAASIMGAM2HPGD | |
| SCHEMBL18610916 | 0.78 | KDM4E (0.61) | GUSBNPC1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL22469017 | 0.77 | GUSB (0.46) | HTR2BGUSBALOX15PTGS2MGAM | |
| SCHEMBL11331284 | 0.77 | MGAM (0.67) | GUSBMGAMGAASIMGAM2 | |
| SCHEMBL14362847 | 0.77 | GUSB (0.56) | GUSBHPGDMEN1NPC1RAB9A | |
| SCHEMBL2439298 | 0.77 | ALDH1A1 (0.62) | GUSBALOX15HPGDMEN1NPC1 | |
| SCHEMBL27639560 | 0.76 | GUSB (0.58) | GUSBHPGDMEN1NPC1RAB9A | |
| SCHEMBL27639592 | 0.76 | GUSB (0.55) | GUSBHPGDMEN1NPC1RAB9A | |
| SCHEMBL2442712 | 0.74 | HSD11B1 (0.54) | HPGDALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6130217-A | ANTITUMOR | PFIZER INC (US) | 2000-10-10 | — | — | US | disclosed |
| WO-1994022846-A1 | COMPOUNDS ENHANCING ANTITUMOR ACTIVITY OF OTHER CYTOTOXIC AGENTS | PFIZER INC. (US) | 1994-10-13 | — | — | WO | disclosed |