Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 3/20 | 0.43 |
| ▸ | HTR1B | P28222 | 3/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | HTR1E | P28566 | 1/20 | 0.43 |
| ▸ | HTR1F | P30939 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
| ▸ | HTR5A | P47898 | 1/20 | 0.43 |
| ▸ | SLC47A1 | Q96FL8 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL8990647 | 0.84 | MAPT (0.38) | MAPTKDM4ETDP1ALDH1A1MEN1 | |
| SCHEMBL8158813 | 0.76 | HTR1D (0.45) | HTR1DHTR1BHTR1AHTR2AHTR2C | |
| SCHEMBL8990658 | 0.75 | MAPT (0.41) | MAPTKDM4EALDH1A1MEN1PABPC1 | |
| SCHEMBL8158816 | 0.74 | HTR1D (0.59) | HTR1DHTR1BHTR1AHTR2AHTR2C | |
| Sulfuric Acid SCHEMBL8624153 | 0.74 | HTR1D (0.42) | HTR1DHTR1BHTR1AHTR2AHTR2C | |
| SCHEMBL5918472 | 0.74 | CYP19A1 (0.55) | HTR1DHTR1BHTR1AHTR2AHTR2C | |
| SCHEMBL6772720 | 0.72 | GAA (0.51) | HTR1DHTR1BHTR1AHTR2AHTR2C | |
| Sulfuric Acid SCHEMBL8624157 | 0.71 | HTR1D (0.56) | HTR1DHTR1BHTR1AHTR2AHTR2C | |
| Succinic Acid SCHEMBL8383592 | 0.70 | ALDH1A1 (0.42) | HTR1DHTR1BHTR1AHTR2AHTR2C | |
| Sulfuric Acid SCHEMBL9705330 | 0.70 | CYP19A1 (0.51) | HTR1DHTR1BHTR1AHTR2AHTR2C |
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-5583149-A | TREATING VASCULAR HEADACHES | BRISTOL-MYERS SQUIBB COMPANY (US) | 1996-12-10 | — | — | US | disclosed |
| US-5468768-A | FOR TREATING VASCULAR HEADACHES | BRISTOL-MYERS SQUIBB COMPANY (US) | 1995-11-21 | — | — | US | disclosed |
| EP-0666258-A1 | Indolylcycloaklanylamin- und Indolylcycloalkenylamine derivatives, their preparation and their use as anti-migraine agents | Bristol-Myers Squibb Company (US) | 1995-08-09 | — | — | EP | disclosed |