Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR183 | P32249 | 3/20 | 0.35 |
| ▸ | MGLL | Q99685 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.33 |
| ▸ | PKLR | P30613 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Trifluoromethanesulfonic Acid SCHEMBL8545942 | 0.90 | MGLL (0.36) | GPR183MGLLTP53USP2TSHR | |
| Trifluoromethanesulfonic Acid SCHEMBL8194433 | 0.88 | HSP90AA1 (0.40) | MGLLTP53MAPT | |
| SCHEMBL8552648 | 0.74 | KDM4E (0.38) | TP53USP2KDM4EALDH1A1HPGD | |
| Trifluoromethanesulfonic Acid SCHEMBL8551955 | 0.69 | KDM4E (0.37) | KDM4EALDH1A1MAPT | |
| Trifluoromethanesulfonic Acid SCHEMBL7144777 | 0.68 | MAPT (0.36) | KDM4EALDH1A1MAPT | |
| Trifluoromethanesulfonic Acid SCHEMBL8549018 | 0.66 | MAPT (0.34) | USP2ALDH1A1HSD17B10MAPT | |
| Trifluoromethanesulfonic Acid SCHEMBL7137485 | 0.64 | POLB (0.38) | — | |
| SCHEMBL15171517 | 0.57 | DRD4 (0.53) | KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL8931318 | 0.56 | ALDH1A1 (0.38) | USP2KDM4EALDH1A1HSD17B10MAPT | |
| SCHEMBL15171673 | 0.56 | PRKAA2 (0.55) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5792763-A | MIGRAINES; ANALGESICS; DISEASES LINKED TO DECREASED NEUROTRANMISSION OF SEROTONIN IN MAMMALS | ELI LILLY AND COMPANY (US) | 1998-08-11 | — | — | US | disclosed |
| WO-1998015545-A1 | NEW SEROTONIN 5-HT1F AGONISTS | ELI LILLY AND COMPANY (US) | 1998-04-16 | — | — | WO | disclosed |
| EP-0835869-A2 | New serotonin 5-HT1F agonists | ELI LILLY AND COMPANY (US) | 1998-04-15 | — | — | EP | disclosed |