Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 1/20 | 0.44 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL8686264 | 1.00 | CHRNB4 (0.44) | CHRNB4CHRNA3ALDH1A1TSHRSIGMAR1 | |
| SCHEMBL5349178 | 0.79 | ALDH1A1 (0.36) | CHRNB4CHRNA3ALDH1A1TSHRSIGMAR1 | |
| SCHEMBL1006892 | 0.79 | CHRNB4 (0.35) | CHRNB4CHRNA3ALDH1A1TSHRSIGMAR1 | |
| SCHEMBL1006893 | 0.79 | CHRNB4 (0.35) | CHRNB4CHRNA3ALDH1A1TSHRSIGMAR1 | |
| SCHEMBL3982745 | 0.79 | ALDH1A1 (0.47) | CHRNB4CHRNA3ALDH1A1SIGMAR1HTR2C | |
| SCHEMBL191429 | 0.76 | ACMSD (0.49) | CHRNB4CHRNA3SIGMAR1HTR2CTDP1 | |
| SCHEMBL8380044 | 0.76 | ACMSD (0.49) | CHRNB4CHRNA3SIGMAR1HTR2CTDP1 | |
| SCHEMBL24169825 | 0.74 | ALDH1A1 (0.39) | ALDH1A1SIGMAR1HTR2CKDM4ENPC1 | |
| SCHEMBL12811657 | 0.74 | CA12 (0.39) | ALDH1A1SIGMAR1HTR2CHPGDKDM4E | |
| SCHEMBL1109740 | 0.74 | ACMSD (0.47) | CHRNB4CHRNA3SIGMAR1HTR2CTDP1 |
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-5817692-A | THERAPY FOR MALARIA, ENCAPHALITIS | THE JOHNS HOPKINS UNIVERSITY (US) | 1998-10-06 | — | — | US | disclosed |
| US-5672624-A | ANTIMALARIAL DRUGS | THE JOHNS HOPKINS UNIVERSITY (US) | 1997-09-30 | — | — | US | disclosed |