Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.63 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | CNR2 | P34972 | 2/20 | 0.49 |
| ▸ | CNR1 | P21554 | 1/20 | 0.49 |
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | F2 | P00734 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | PAM | P19021 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Phenylacetic Acid SCHEMBL28136535 | 0.90 | AKR1B1 (0.77) | AKR1B1L3MBTL1TDP1LMNAABCC4 | |
| SCHEMBL22068412 | 0.86 | AKR1B1 (0.77) | AKR1B1LMNAABCC4GAATSHR | |
| Phenylacetic Acid SCHEMBL10870034 | 0.86 | AKR1B1 (0.77) | AKR1B1L3MBTL1TDP1LMNAABCC4 | |
| Phenylacetic Acid SCHEMBL8319811 | 0.83 | CA2 (0.67) | AKR1B1L3MBTL1TDP1LMNAABCC4 | |
| SCHEMBL39103 | 0.82 | CA2 (0.62) | AKR1B1TDP1LMNAABCC4GAA | |
| SCHEMBL2525145 | 0.82 | CA2 (0.62) | AKR1B1L3MBTL1TDP1LMNAABCC4 | |
| Phenylacetic Acid SCHEMBL28199060 | 0.82 | AKR1B1 (0.85) | AKR1B1LMNAABCC4GAATSHR | |
| SCHEMBL92022 | 0.82 | CA2 (0.62) | AKR1B1L3MBTL1TDP1LMNAABCC4 | |
| SCHEMBL1331730 | 0.82 | CA2 (0.62) | AKR1B1TDP1LMNAABCC4GAA | |
| 4-Methylbenzoic Acid SCHEMBL8360450 | 0.81 | ALDH1A1 (0.63) | AKR1B1L3MBTL1TDP1LMNAABCC4 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2002059655-A | THERMAL RECORDING MATERIAL | SAITO KASEIHIN KENKYUSHO:KK | 2002-02-26 | — | — | JP | disclosed |