Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | TACR1 | P25103 | 1/20 | 0.40 |
| ▸ | UTS2R | Q9UKP6 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ACACB | O00763 | 1/20 | 0.37 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.36 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.36 |
| ▸ | PLA2G2C | Q5R387 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7734496 | 1.00 | ADORA2A (0.46) | ADORA2AADORA1ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL7734537 | 0.87 | UTS2R (0.40) | ALDH1A1UTS2RACACBCNR2 | |
| SCHEMBL7733448 | 0.87 | UTS2R (0.40) | ALDH1A1UTS2RACACBCNR2 | |
| SCHEMBL7733850 | 0.87 | MAPK1 (0.42) | ALDH1A1MAPT | |
| SCHEMBL7736428 | 0.87 | MEN1 (0.50) | MEN1KMT2AACACBTAS1R3TAS1R1 | |
| SCHEMBL7723794 | 0.87 | MEN1 (0.50) | MEN1KMT2AACACBTAS1R3TAS1R1 | |
| SCHEMBL7731987 | 0.87 | MAPK1 (0.42) | ALDH1A1MAPT | |
| SCHEMBL7733583 | 0.87 | TSHR (0.49) | ALDH1A1LMNASMN1; SMN2MAPTL3MBTL1 | |
| SCHEMBL7733440 | 0.87 | TSHR (0.49) | ALDH1A1LMNASMN1; SMN2MAPTL3MBTL1 | |
| SCHEMBL7733582 | 0.85 | MEN1 (0.54) | ALDH1A1MEN1KMT2ACYP3A4ACACB |
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-6399787-B1 | TRANSITION METAL COMPLEX | PENN STATE RESEARCH FOUNDATION | 2002-06-04 | — | — | US | disclosed |
| WO-1999059721-A1 | CATALYTIC ASYMMETRIC HYDROGENATION, HYDROFORMYLATION, AND HYDROVINYLATION VIA TRANSITION METAL CATALYSTS WITH PHOSPHINES AND PHOSPHITES | THE PENN STATE RESEARCH FOUNDATION (US) | 1999-11-25 | — | — | WO | disclosed |