Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | OXTR | P30559 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | JMJD6 | Q6NYC1 | 1/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | NNMT | P40261 | 1/20 | 0.33 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.33 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.33 |
| ▸ | MEN1 | O00255 | 4/20 | 0.33 |
| ▸ | POLB | P06746 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20153360 | 0.86 | OXTR (0.34) | KDM4EALDH1A1OXTRMAPTRAB9A | |
| SCHEMBL20153309 | 0.83 | KDM4E (0.35) | KDM4EALDH1A1HTTOXTRMAPT | |
| SCHEMBL21311520 | 0.83 | ITGB3 (0.37) | KDM4EALDH1A1HTTOXTRMAPT | |
| SCHEMBL21311585 | 0.82 | OXTR (0.36) | KDM4EALDH1A1HTTOXTRMAPT | |
| SCHEMBL20153308 | 0.82 | KDM4E (0.35) | KDM4EALDH1A1HTTOXTRMAPT | |
| SCHEMBL20153325 | 0.81 | FYN (0.41) | OXTRJMJD6KMT2AMEN1 | |
| SCHEMBL20153458 | 0.81 | OXTR (0.35) | KDM4EALDH1A1HTTOXTRMAPT | |
| SCHEMBL23677937 | 0.80 | JMJD6 (0.36) | KDM4EALDH1A1HTTOXTRMAPT | |
| SCHEMBL21311521 | 0.77 | ITGB3 (0.38) | ITGB3ITGAV | |
| SCHEMBL20153330 | 0.76 | OXTR (0.35) | KDM4EALDH1A1HTTOXTRJMJD6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3538525-B1 | 3-SUBSTITUTED PROPIONIC ACIDS AS ALPHA V INTEGRIN INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2022-06-22 | — | — | EP | disclosed |
| WO-2018089353-A1 | 3-SUBSTITUTED PROPIONIC ACIDS AS ALPHA V INTEGRIN INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-05-17 | — | — | WO | disclosed |