Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 2/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.32 |
| ▸ | HTR6 | P50406 | 2/20 | 0.32 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.32 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8852085 | 0.83 | DAO (0.42) | DAOSIGMAR1HPGDLMNAMAPT | |
| SCHEMBL1254485 | 0.81 | TAAR1 (0.56) | DAOSIGMAR1HPGDLMNAMAPT | |
| SCHEMBL31618191 | 0.81 | TAAR1 (0.56) | DAOSIGMAR1HPGDLMNAMAPT | |
| Hydrochloric Acid SCHEMBL15211380 | 0.79 | TAAR1 (0.54) | DAOSIGMAR1HPGDLMNAMAPT | |
| SCHEMBL1229631 | 0.76 | DAO (0.44) | DAOSIGMAR1HPGDLMNAMAPT | |
| SCHEMBL30975082 | 0.76 | DAO (0.44) | DAOSIGMAR1HPGDLMNAMAPT | |
| SCHEMBL8851892 | 0.75 | CYP1A2 (0.54) | HPGDLMNAMAPTHTTTAAR1 | |
| SCHEMBL31618228 | 0.75 | TAAR1 (0.61) | SLC6A4SLC6A3TAAR1HTR6 | |
| SCHEMBL9346870 | 0.75 | DAO (0.38) | DAOSIGMAR1HPGDLMNAMAPT | |
| SCHEMBL15352024 | 0.74 | DAO (0.46) | DAOSIGMAR1HPGDLMNAMAPT |
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-5618814-A | Trisubstituted pyrimido [5,4-d] pyrimidines for modulating multi-drug resistance and pharmaceutical compositions containing these compounds | DR. KARL THOMAE GMBH (DE) | 1997-04-08 | — | — | US | disclosed |