Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 7/20 | 0.59 |
| ▸ | MAPT | P10636 | 7/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | LMNA | P02545 | 5/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.55 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.55 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.55 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.55 |
| ▸ | HTR1A | P08908 | 1/20 | 0.55 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.55 |
| ▸ | DRD2 | P14416 | 1/20 | 0.55 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.55 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.55 |
| ▸ | DRD1 | P21728 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL9815989 | 0.86 | ABCB1 (0.60) | ABCB1MAPTALDH1A1LMNAKDM4E | |
| SCHEMBL11071634 | 0.85 | ABCB1 (0.65) | ABCB1MAPTALDH1A1LMNAKDM4E | |
| Hydrochloric Acid SCHEMBL11073354 | 0.83 | HTR7 (0.64) | ABCB1MAPTALDH1A1LMNAMAPK1 | |
| SCHEMBL11076722 | 0.83 | MAPT (0.65) | ABCB1MAPTLMNAMAPK1KCNH2 | |
| SCHEMBL21792814 | 0.80 | MAPT (0.73) | MAPTALDH1A1LMNAKDM4EMAPK1 | |
| SCHEMBL30001178 | 0.80 | MAPT (0.73) | MAPTALDH1A1LMNAKDM4EMAPK1 | |
| SCHEMBL11071604 | 0.79 | MAPT (0.65) | ABCB1MAPTALDH1A1LMNAKDM4E | |
| SCHEMBL17313697 | 0.79 | KCNH2 (0.78) | ABCB1MAPTALDH1A1LMNAKDM4E | |
| SCHEMBL9816000 | 0.79 | MAPT (0.64) | ABCB1MAPTALDH1A1LMNAKDM4E | |
| SCHEMBL11071611 | 0.78 | MAPT (0.63) | ABCB1MAPTALDH1A1LMNAKDM4E |
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-4428950-A | HYPOTENSIVES, SEDATIVES, NEUROLEPTICS AND BRONCHOLYTICS | BASF AKTIENGESELLSCHAFT (DE) | 1984-01-31 | — | — | US | disclosed |