Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 8/20 | 0.53 |
| ▸ | NPC1 | O15118 | 6/20 | 0.53 |
| ▸ | RAB9A | P51151 | 6/20 | 0.53 |
| ▸ | HTT | P42858 | 4/20 | 0.53 |
| ▸ | CASP3 | P42574 | 2/20 | 0.53 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.53 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.53 |
| ▸ | SENP6 | Q9GZR1 | 2/20 | 0.53 |
| ▸ | MMP2 | P08253 | 1/20 | 0.53 |
| ▸ | MMP9 | P14780 | 1/20 | 0.53 |
| ▸ | MMP8 | P22894 | 1/20 | 0.53 |
| ▸ | MMP13 | P45452 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.52 |
| ▸ | MEN1 | O00255 | 6/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | POLB | P06746 | 3/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL7035367 | 0.92 | ALDH1A1 (0.61) | ALDH1A1TDP1RIPK1MAPTNPC1 | |
| SCHEMBL7970193 | 0.89 | ALDH1A1 (0.48) | ALDH1A1TDP1RIPK1MAPTNPC1 | |
| SCHEMBL22091228 | 0.89 | RIPK1 (0.64) | ALDH1A1TDP1RIPK1MAPTNPC1 | |
| SCHEMBL22091270 | 0.85 | ALDH1A1 (0.58) | ALDH1A1TDP1RIPK1MAPTNPC1 | |
| Hydrochloric Acid SCHEMBL22091257 | 0.84 | ALDH1A1 (0.57) | ALDH1A1TDP1RIPK1MAPTNPC1 | |
| SCHEMBL22091187 | 0.81 | ALDH1A1 (0.52) | ALDH1A1TDP1RIPK1MAPTNPC1 | |
| SCHEMBL3576328 | 0.80 | ALDH1A1 (0.52) | ALDH1A1TDP1RIPK1MAPTNPC1 | |
| SCHEMBL22091248 | 0.79 | RAB9A (0.50) | ALDH1A1TDP1RIPK1MAPTNPC1 | |
| SCHEMBL22091372 | 0.79 | HTT (0.55) | ALDH1A1TDP1RIPK1MAPTNPC1 | |
| SCHEMBL22091294 | 0.79 | ALDH1A1 (0.50) | ALDH1A1TDP1RIPK1MAPTNPC1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020120576-A1 | p38α AUTOPHOSPHORYLATION INHIBITORS | FUNDACIÓ INSTITUT DE RECERCA BIOMÈDICA (IRB BARCELONA) (ES) | 2020-06-18 | — | — | WO | disclosed |
| US-6303627-B1 | FOR THERAPY OF PHYSIOLOGICAL AND PSYCHOLOGICAL DISORDERS | ELI LILLY AND COMPANY | 2001-10-16 | — | — | US | disclosed |
| WO-1999065487-A1 | INHIBITORS OF SEROTONIN REUPTAKE | ELI LILLY AND COMPANY (US) | 1999-12-23 | — | — | WO | disclosed |
| EP-0965587-A1 | Tetrahydropyridinyl- and piperidinyl Inhibitors of serotonin reuptake | ELI LILLY AND COMPANY (US) | 1999-12-22 | — | — | EP | disclosed |