Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 9/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.50 |
| ▸ | RECQL | P46063 | 7/20 | 0.50 |
| ▸ | MAPT | P10636 | 6/20 | 0.50 |
| ▸ | LMNA | P02545 | 4/20 | 0.50 |
| ▸ | BLM | P54132 | 4/20 | 0.50 |
| ▸ | APEX1 | P27695 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | MTOR | P42345 | 2/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | THPO | P40225 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.47 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.47 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11664750 | 0.82 | CA1 (0.44) | TDP1KDM4ERECQLMAPTLMNA | |
| SCHEMBL7192536 | 0.79 | TDP1 (0.50) | TDP1KDM4ERECQLMAPTLMNA | |
| SCHEMBL10401987 | 0.79 | TDP1 (0.50) | TDP1KDM4ERECQLMAPTLMNA | |
| SCHEMBL31347517 | 0.78 | TUBB4A (0.50) | TDP1KDM4ERECQLMAPTLMNA | |
| SCHEMBL18869251 | 0.77 | TDP1 (0.58) | TDP1KDM4ERECQLMAPTLMNA | |
| SCHEMBL891506 | 0.77 | TSHR (0.50) | TDP1KDM4ERECQLMAPTLMNA | |
| SCHEMBL7262480 | 0.77 | TSHR (0.50) | TDP1KDM4ERECQLMAPTLMNA | |
| SCHEMBL11301520 | 0.76 | ESR1 (0.60) | TDP1KDM4EMAPTLMNAAPEX1 | |
| SCHEMBL21741892 | 0.75 | TDP1 (0.50) | TDP1KDM4ERECQLMAPTLMNA | |
| SCHEMBL14700223 | 0.75 | TDP1 (0.49) | TDP1KDM4ERECQLMAPTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-5536865-A | Process for the preparation of 5,6-dihydroxyindole and intermediate compounds | L'OREAL (FR) | 1996-07-16 | — | — | US | disclosed |
| US-5508464-A | NITRATING OF A 4,5-DIBENZYLOXYPHENYLACETONITRILE, FOLLOWED BY DEBENZYLATION, HYDROGENATION AND CYCLIZATION | L'OREAL (FR) | 1996-04-16 | — | — | US | disclosed |
| US-5498746-A | Process for the preparation of 5,6-dihydroxyindole and intermediate compounds | L'OREAL (FR) | 1996-03-12 | — | — | US | disclosed |
| US-5410067-A | Catalytic hydrogenation; cyclization | L'OREAL (FR) | 1995-04-25 | — | — | US | disclosed |