Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 3/20 | 0.37 |
| ▸ | MAOA | P21397 | 2/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | TARBP2 | Q15633 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.33 |
| ▸ | CTSA | P10619 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL22238937 | 0.91 | CYP2C19 (0.41) | AAK1MAOAMAOBNR1H4TARBP2 | |
| SCHEMBL16265325 | 0.86 | RARB (0.41) | ALDH1A1HPGDMAPTCYP3A4POLB | |
| SCHEMBL18418549 | 0.85 | RARA (0.36) | ALDH1A1MAPTCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL25070538 | 0.85 | RARA (0.32) | — | |
| SCHEMBL20975632 | 0.83 | RARA (0.35) | ALDH1A1MAPTCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL25070640 | 0.83 | ALDH1A1 (0.37) | AAK1ALDH1A1CYP3A4XDHGAA | |
| SCHEMBL20806064 | 0.83 | NR1H4 (0.42) | AAK1NR1H4TARBP2KDM4EALDH1A1 | |
| SCHEMBL19682268 | 0.82 | APP (0.41) | PDK2CYP3A4POLBCYP2C9CYP2C19 | |
| SCHEMBL20806211 | 0.82 | PDK2 (0.35) | AAK1MAOAMAOBPDK2ACACB | |
| SCHEMBL22299384 | 0.82 | RARA (0.36) | AAK1ALDH1A1MAPTCYP3A4CYP2C9 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230053362-A1 | DICHROIC DYE COMPOSITION | MERCK PATENT GMBH (DE) | 2023-02-23 | — | — | US | disclosed |