Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.47 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.47 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | CSF1R | P07333 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9511034 | 1.00 | MAPT (0.49) | MAPTCYP1A2CYP3A4CYP2D6CYP1A1 | |
| SCHEMBL9724840 | 0.79 | CYP11B2 (0.65) | MAPTCYP1A2CYP3A4CYP2D6CYP1A1 | |
| SCHEMBL9724843 | 0.79 | CYP11B2 (0.65) | MAPTCYP1A2CYP3A4CYP2D6CYP1A1 | |
| SCHEMBL9509602 | 0.78 | MAPT (0.59) | MAPTCYP1A2CYP3A4CYP2D6CYP1A1 | |
| SCHEMBL9509612 | 0.78 | CYP11B2 (0.44) | MAPTCYP1A2CYP3A4CYP2D6CYP1A1 | |
| SCHEMBL9509605 | 0.78 | CYP11B2 (0.44) | MAPTCYP1A2CYP3A4CYP2D6CYP1A1 | |
| SCHEMBL9509599 | 0.78 | MAPT (0.59) | MAPTCYP1A2CYP3A4CYP2D6CYP1A1 | |
| SCHEMBL9507267 | 0.78 | KMT2A (0.55) | MAPTCYP1A2CYP3A4CYP2D6CYP1A1 | |
| SCHEMBL9507274 | 0.78 | KMT2A (0.55) | MAPTCYP1A2CYP3A4CYP2D6CYP1A1 | |
| SCHEMBL9509528 | 0.77 | CYP11B2 (0.47) | MAPTCYP1A2CYP3A4CYP2D6CYP1A1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-1034940-A | — | — | None | — | — | JP | disclosed |
| EP-0298380-B1 | PROCESS FOR THE PREPARATION OF ALPHA-BETA-SUBSTITUTED ACROLEINS | BASF Aktiengesellschaft (DE) | 1993-09-29 | — | — | EP | disclosed |
| US-4920232-A | CHEMICAL INTERMEDIATES | BASF AKTIENGESELLSCHAFT (DE) | 1990-04-24 | — | — | US | disclosed |
| EP-0298380-A2 | Process for the preparation of alpha-beta-substituted acroleins | BASF Aktiengesellschaft (DE) | 1989-01-11 | — | — | EP | disclosed |